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ISRIUM2014
The International Symposium on Reactive Intermediates and Unusual Molecules 2014
Technical Program

Remark: The presenter of each paper is marked with "*".
Technical Program:   One Page (Not Separated) version
Author Index:   HERE

Session Schedule


Tuesday, April 1, 2014

Registration (Multi-Purpose Studio (2F))
17:00 - 20:00
Mixer (Cafe & Restaurant Rencontre (1F))
18:00 - 20:30

Wednesday, April 2, 2014

Multi-Purpose Studio (2F)
1-1
9:00 - 10:30
1-2
10:30 - 11:30
Lunch (Buffet Restaurant for Seasons (Hiroshima City Cultural Exchange Hall 1F))
11:30 - 13:30
1-3
13:30 - 15:30
Break
15:30 - 15:40
1-4
15:40 - 18:00

Thursday, April 3, 2014

Multi-Purpose Studio (2F)
2-1
9:00 - 10:10
2-2
10:10 - 12:00
Lunch (Buffet Restaurant for Seasons (Hiroshima City Cultural Exchange Hall 1F))
12:00 - 13:30
2-3
13:30 - 15:10
Break
15:10 - 15:20
2-4
15:20 - 17:30
P  (Public Gallery (1F))
Poster

17:30 - 19:30

Friday, April 4, 2014

Multi-Purpose Studio (2F)
3-1
9:00 - 10:20
3-2
10:20 - 11:50
Lunch (Buffet Restaurant for Seasons (Hiroshima City Cultural Exchange Hall 1F))
11:50 - 13:30
3-3
13:30 - 15:10
Break
15:10 - 15:20
3-4
15:20 - 17:10
Banquet (Hiroshima Museum: Banquet at Tea Room after Art Appreciation)
18:00 - 20:00

Saturday, April 5, 2014

Multi-Purpose Studio (2F)
4-1
9:00 - 10:10
4-2
10:10 - 12:20
Lunch: BENTO (Cafe & Restaurant Rencontre (1F))
12:20 - 13:00
Excursion: Miyajama Short Trip (Dinner at Aki Grand Hotel)
12:20 - 21:00

Sunday, April 6, 2014

Multi-Purpose Studio (2F)
5-1
9:00 - 10:20
5-2
10:20 - 11:50
End of Symposium
11:50 - 12:20
Lunch (Buffet Restaurant for Seasons (Hiroshima City Cultural Exchange Hall 1F))
12:20 - 13:30


List of Papers

Remark: The presenter of each paper is marked with "*".

Wednesday, April 2, 2014

Session 1-1 
Time: 9:00 - 10:30 Wednesday, April 2, 2014
Location: Multi-Purpose Studio (2F)
Chair: Heinz D. Roth (Rutgers Univ., U.S.A.)

1-1-1 (Time: 9:00 - 9:30)
Title(Invited Talk) Quantitative Results for Halocarbene Equilibria
Author*Robert A. Moss (Rutgers, The State Univ. of New Jersey, U.S.A.)
Pagep. 1

1-1-2 (Time: 9:30 - 10:00)
Title(Invited Talk) How the Ground Spin State of a Carbene is Switched by Solvent Interactions
AuthorPaolo Costa, Genevičve Richter, *Wolfram Sander (Ruhr Univ. Bochum, Germany)
Pagep. 2

1-1-3 (Time: 10:00 - 10:30)
Title(Invited Talk) Supramolecular Carbene and Nitrene Chemistry
Author*Udo H. Brinker (Univ. of Vienna, Austria)
Pagep. 3


Session 1-2 
Time: 10:30 - 11:30 Wednesday, April 2, 2014
Location: Multi-Purpose Studio (2F)
Chair: Robert McMahon (Univ. of Wisconsin, U.S.A.)

1-2-1 (Time: 10:30 - 11:00)
Title(Invited Talk) Steric Protection of Triplet Diarylcarbenes
Author*Katsuyuki Hirai (Mie Univ., Japan)
Pagep. 4

1-2-2 (Time: 11:00 - 11:30)
Title(Invited Talk) Toward Synthesis of Thermally Stable Triplet Carbenes
AuthorShin-ichi Fuku-en (Hiroshima Univ., Japan), Ko Furukawa (Niigata Univ., Japan), *Yohsuke Yamamoto (Hiroshima Univ., Japan)
Pagep. 5


Session 1-3 
Time: 13:30 - 15:30 Wednesday, April 2, 2014
Location: Multi-Purpose Studio (2F)
Chair: Robert Moss (Rutgers Univ., Germany)

1-3-1 (Time: 13:30 - 14:00)
Title(Invited Talk) Loschmidt’s Benzene Isomer and Reluctant Carbene
Author*Heinz D. Roth, Ronald R. Sauers (Rutgers Univ., U.S.A.)
Pagep. 6

1-3-2 (Time: 14:00 - 14:30)
Title(Invited Talk) Quantum Mechanical Tunneling Reactions of Carbenes and Nitrenes
AuthorHiroshi Inui (Kitasato Univ., Japan), *Robert McMahon (Univ. of Wisconsin-Madison, U.S.A.)
Pagep. 7

1-3-3 (Time: 14:30 - 15:00)
Title(Invited Talk) New Advances in P(I) Chemistry
Author*Francois Mathey (Nanyang Technological Univ., Singapore)
Pagep. 8

1-3-4 (Time: 15:00 - 15:30)
Title(Invited Talk) Proton Transfer Reactions of the Conjugate Acids of 1,2,4-Triazolylidenes: Unusual N-Aryl Substituent Effects
AuthorRichard S. Massey, Peter Quinn, David E. Tucker, *AnnMarie C. O'Donoghue (Durham Univ., U.K.)
Pagep. 9


Session 1-4 
Time: 15:40 - 18:00 Wednesday, April 2, 2014
Location: Multi-Purpose Studio (2F)
Chair: Wolfram Sander (Ruhr Univ. Bochum, Germany)

1-4-1 (Time: 15:40 - 16:10)
Title(Invited Talk) N,N’-Diamidocarbenes: Design, Synthesis and Applications
Author*Christopher W. Bielawski (Univ. of Texas, Austin, U.S.A.)
Pagep. 10

1-4-2 (Time: 16:10 - 16:40)
Title(Invited Talk) Synchronized Aromaticity as an Enthalpic Driving Force for the Aromatic Cope Rearrangement
AuthorDavid J. Babinski (Univ. of Texas, San Antonio, U.S.A.), Xiaoguang Bao (Univ. of North Texas, U.S.A.), Marie El Arbe (Univ. of Texas, San Antonio, U.S.A.), Bo Chen, David Hrovat, Weston Thatcher Borden (Univ. of North Texas, U.S.A.), *Doug Frantz (Univ. of Texas, San Antonio, U.S.A.)
Pagep. 11

1-4-3 (Time: 16:40 - 17:10)
Title(Invited Talk) Stereoselective Reactions of Oxocarbenium Ions: Conformational Analysis, Stereoelectronic Effects, and Neighboring-Group Effects
Author*Keith Woerpel (New York Univ., U.S.A.)
Pagep. 12

1-4-4 (Time: 17:10 - 17:30)
TitleHydrolysis and Aminolysis Studies of Phosphodichloridate and Thiophosphodichloridate Ions
AuthorRichard J. Delley, AnnMarie C. O'Donoghue, *David R. W. Hodgson (Durham Univ., U.K.)
Pagep. 13

1-4-5 (Time: 17:30 - 18:00)
Title(Invited Talk) Cyclobutadienes and Tetrahedranes
Author*Akira Sekiguchi (Univ. of Tsukuba, Japan)
Pagep. 14



Thursday, April 3, 2014

Session 2-1 
Time: 9:00 - 10:10 Thursday, April 3, 2014
Location: Multi-Purpose Studio (2F)
Chair: Fabien Borget (Aix Marseille Univ., France)

2-1-1 (Time: 9:00 - 9:30)
Title(Invited Talk) The Pyrolysis of Isoxazoles Revisited: the Pivotal Role of Vinylnitrenes
AuthorTomáš Šolomek (Univ. of Fribourg, Switzerland), Cláudio Nunes, Igor Reva, Rui Fausto (Univ. of Coimbra, Portugal), *Thomas Bally (Univ. of Fribourg, Switzerland)
Pagep. 15

2-1-2 (Time: 9:30 - 9:50)
TitleA Quantum Mechanics/Molecular Mechanics (QM/MM) Perspective of Reactive Intermediates and Non-covalent Interactions
AuthorRachel Crespo-Otero, Kenny Bravo-Rodriguez, Iakov Polyak, *Elsa Sanchez-Garcia (Max-Planck-Institut für Kohlenforschung, Germany)
Pagep. 16

2-1-3 (Time: 9:50 - 10:10)
TitleThermally Stable Reactive Intermediates of the Reduction of SO2 on Carbons
Author*Eduardo Humeres, Nito A. Debacher, Alessandra Smaniotto, Karen M. de Castro, Regina de F.P.M. Moreira (Univ. Federal de Santa Catarina, Brazil), Moisés Canle, J. Arturo Santaballa (Univ. da Coruńa, Spain)
Pagep. 17


Session 2-2 
Time: 10:10 - 12:00 Thursday, April 3, 2014
Location: Multi-Purpose Studio (2F)
Chair: Anna D. Gudmundsdottir (Univ. of Cincinnati, U.S.A.)

2-2-1 (Time: 10:10 - 10:40)
Title(Invited Talk) What are the Intermediates that Could React in the Interstellar Ices ?
Author*Fabien Borget, Fabrice Duverany, Grégoire Danger, Patrice Theulé, Vassilissa Vinogradoff, Thierry Chiavassa (Aix Marseille Univ., France), Sandra Muller, Dirk Grote, Wolfram Sander (Ruhr Univ. Bochum, Germany)
Pagep. 18

2-2-2 (Time: 10:40 - 11:00)
TitleIntermediates in the Oxidation of Acenes with Singlet Oxygen
Author*Torsten Linker (Univ. of Potsdam, Germany)
Pagep. 19

2-2-3 (Time: 11:00 - 11:30)
Title(Invited Talk) Computational and Experimental Studies of Damaged Nucleobases: What Gas Phase Results Can Tell Us About Catalytic Mechanisms
Author*Jeehiun Katherine Lee (Rutgers Univ., U.S.A.)
Pagep. 20

2-2-4 (Time: 11:30 - 12:00)
Title(Invited Talk) Metal-Mediated C-N Bond Coupling in the Gas Phase: Experiment and Theory in Concert
Author*Helmut Schwarz, Robert Kretschmer, Maria Schlangen (Technische Univ. Berlin, Germany)
Pagep. 21


Session 2-3 
Time: 13:30 - 15:10 Thursday, April 3, 2014
Location: Multi-Purpose Studio (2F)
Chair: Thomas Bally (Univ. of Fribourg, Switzerland)

2-3-1 (Time: 13:30 - 14:00)
Title(Invited Talk) Charge Delocalization in Cyclophanes
AuthorMamoru Fujitsuka, *Tetsuro Majima (Osaka Univ., Japan)
Pagep. 22

2-3-2 (Time: 14:00 - 14:20)
TitleThe Photochemistry of Nitrocorannulene
Author*Kelley McKissic, Qian Li, Sujan Sarkar, James Mack, Anna Gudmundsdottir (Univ. of Cincinnati, U.S.A.)
Pagep. 23

2-3-3 (Time: 14:20 - 14:40)
TitleNew Photolatent Amine Catalysts for Photopolymerization Reactions
Author*Xavier Allonas, Hanen Salmi, Christian Ley (Univ. of Haute Alsace, France)
Pagep. 24

2-3-4 (Time: 14:40 - 15:10)
Title(Invited Talk) Spectroscopic and Exploratory Study of the Organic Radical Cation with the Nature of One-Electron σ Bond
Author*Hiroshi Ikeda (Osaka Prefecture Univ., Japan)
Pagep. 25


Session 2-4 
Time: 15:20 - 17:30 Thursday, April 3, 2014
Location: Multi-Purpose Studio (2F)
Chair: Rainer Herges (Univ. of Kiel, Germany)

2-4-1 (Time: 15:20 - 15:50)
Title(Invited Talk) Nitrile Imines, Carbodiimides and 1H-Diazirenes. Photo- and Thermo-Chemistry of Tetrazoles and Sydnones
Author*Curt Wentrup (Univ. of Queensland, Australia)
Pagep. 26

2-4-2 (Time: 15:50 - 16:20)
Title(Invited Talk) Solid State Reactivity and Kinetics of Biradicals
Author*Anna Gudmundsdottir, Upul Ranaweera, Sujan Sarkar (Univ. of Cincinnati, U.S.A.)
Pagep. 27

2-4-3 (Time: 16:20 - 16:50)
Title(Invited Talk) Electron and Hydrogen Transfer in Organic Photochemical Reactions
Author*Norbert Hoffmann (Univ. de Reims, France)
Pagep. 28

2-4-4 (Time: 16:50 - 17:20)
Title(Invited Talk) From Mechanistic Studies to Practical Applications: The Naphthoquinone Methides Case
Author*Vladimir V. Popik (Univ. of Georgia, U.S.A.)
Pagep. 29

2-4-5 (Time: 17:20 - 17:40)
TitleChallenges in the Development of Visible Light-Activatable Groups and NIR Fluorescent Probes
Author*Petr Klán (Masaryk Univ., Czech Republic)
Pagep. 30



Friday, April 4, 2014

Session 3-1 
Time: 9:00 - 10:20 Friday, April 4, 2014
Location: Multi-Purpose Studio (2F)
Chair: Igor Alabugin (Florida State Univ., U.S.A.)

3-1-1 (Time: 9:00 - 9:20)
TitleZethrenes and Extended p-Quinodimethanes with an Open-Shell Biradical Ground State
Author*Jishan Wu (National Univ. of Singapore, Singapore)
Pagep. 31

3-1-2 (Time: 9:20 - 9:50)
Title(Invited Talk) Investigating the Dimerizations of Phenalenyl Radicals
Author*Takashi Kubo (Osaka Univ., Japan)
Pagep. 32

3-1-3 (Time: 9:50 - 10:20)
Title(Invited Talk) New Aspects of Nitronyl Nitroxides in Chemistry
Author*Keiji Okada (Osaka City Univ., Japan)
Pagep. 33


Session 3-2 
Time: 10:20 - 11:50 Friday, April 4, 2014
Location: Multi-Purpose Studio (2F)
Chair: Gernot Frenking (Philipps-Univ. Marburg, Germany)

3-2-1 (Time: 10:20 - 10:50)
Title(Invited Talk) Why Is the Effect of the Substitution of Oxygen for CH2 on the Singlet-Triplet Energy Splitting Completely Different in meta-Benzoquinodimethane than in Trimethylenemethane? Negative Ion Photoelectron Spectroscopy Confirms the Explanation Given by Calculations and by Qualitative Theory
AuthorS. H. M. Deng, Jian Zhang, Xuebin Wang (Pacific Northwest National Laboratory, U.S.A.), Bo Chen, David A. Hrovat, *Weston Thatcher Borden (Univ. of North Texas, U.S.A.)
Pagep. 34

3-2-2 (Time: 10:50 - 11:20)
Title(Invited Talk) Theoretical Study on the Relationship between Diradical Character and Nonlinear Optical Properties in Open-Shell Singlet Molecular Systems
Author*Masayoshi Nakano (Osaka Univ., Japan)
Pagep. 35

3-2-3 (Time: 11:20 - 11:50)
Title(Invited Talk) Frontier Orbital Rule for Electron Transport in Molecules
Author*Kazunari Yoshizawa (Kyushu Univ., Japan)
Pagep. 36


Session 3-3 
Time: 13:30 - 15:10 Friday, April 4, 2014
Location: Multi-Purpose Studio (2F)
Chair: Udo H. Brinker (Univ. of Vienna, Austria)

3-3-1 (Time: 13:30 - 13:50)
TitleProton Coupled Electron Transfer in Hydrogen-Bonded Complexes Based on a Phenol/Phenoxyl Pair
Author*Yasukazu Hirao, Miki Marutani, Kazuki Isogai, Tomohiko Nishiuchi, Hiroyuki Kurata, Takashi Kubo (Osaka Univ., Japan)
Pagep. 37

3-3-2 (Time: 13:50 - 14:20)
Title(Invited Talk) Design and Synthesis of the First Triply Twisted Möbius Annulene
Author*Rainer Herges, Gaston Schaller (Univ. of Kiel, Germany)
Pagep. 38

3-3-3 (Time: 14:20 - 14:50)
Title(Invited Talk) 1,1,n,n-Tetramethyl[n](2,11)teropyrenophanes – Very Large [n]Cyclophanes with Very Bent Aromatic Systems that Map onto the Surfaces of Armchair SWCNTs
AuthorKiran Sagar Unikela, *Graham J. Bodwell (Memorial Univ., Canada)
Pagep. 39

3-3-4 (Time: 14:50 - 15:10)
Titlesp-Hybridized Carbon: On the Way to Synthetic Carbon Allotropes
Author*Rik Raymond Tykwinski, Michael Franz, Levon D. Movsisyan, Dominik Wendinger, Johanna A. Januszewski (Univ. of Erlangen-Nuremberg, Germany), Harry L. Anderson (Oxford Univ., U.K.)
Pagep. 40


Session 3-4 
Time: 15:20 - 17:10 Friday, April 4, 2014
Location: Multi-Purpose Studio (2F)
Chair: Josef Michl (Univ. of Colorado/Academy of Sciences of the Czech Republic, U.S.A.)

3-4-1 (Time: 15:20 - 15:50)
Title(Invited Talk) Stereoelectronic Control of Cyclizations and Fragmentations
Author*Igor V. Alabugin, Kerry Gilmore, Sayantan Mondal, Brian Gold, Rana Mohamed, Philip Byers (Florida State Univ., U.S.A.)
Pagep. 41

3-4-2 (Time: 15:50 - 16:10)
TitleExperimental and Quantum Chemical Characterization of the First Acetylenedicarboxamidinium Dication. Distonic and Gitonic Character?
Author*Hans-Ullrich Siehl, Jakob Kottmann, Olga Wassiljew (Ulm Univ., Germany), Konstantin Drandarov, Ioannis Tiritiris, Willi Kantlehner (Univ. of Applied Sciences, Aalen, Germany)
Pagep. 42

3-4-3 (Time: 16:10 - 16:40)
Title(Invited Talk) Reaction Behavior of Main-Group Element Compound in Comparison with Transition-Metal Complex: Theoretical Understanding and Prediction
Author*Shigeyoshi Sakaki (Kyoto Univ., Japan)
Pagep. 43

3-4-4 (Time: 16:40 - 17:10)
Title(Invited Talk) Gas Phase Thermochemistry in Organic and Organometallic Chemistry
Author*Peter Chen (ETH Zürich, Switzerland)
Pagep. 44



Saturday, April 5, 2014

Session 4-1 
Time: 9:00 - 10:10 Saturday, April 5, 2014
Location: Multi-Purpose Studio (2F)
Chair: Holger F. Bettinger (Univ. of Tuebingen, Germany)

4-1-1 (Time: 9:00 - 9:20)
TitleEvidence for a New Type of Bonding in a Radical Complex between a Thioether Radical Cation and a Phenyl Group
Author*Nicolas P.-A. Monney, Thomas Bally (Univ. of Fribourg, Switzerland), Richard S. Glass (Univ. of Arizona, Tucson, U.S.A.)
Pagep. 45

4-1-2 (Time: 9:20 - 9:50)
Title(Invited Talk) Persistent Neutral Two-Coordinate Radicals of Heavy Group-15 Elements
Author*Takeaki Iwamoto, Fumiya Hirakawa, Shintaro Ishida (Tohoku Univ., Japan)
Pagep. 46

4-1-3 (Time: 9:50 - 10:10)
TitleAlpha-Oxo Nitrenes: Characterization and Applications for Preparing Synthetically Challenging Small Molecules
Author*Xiaoqing Zeng (Soochow Univ., China), Helmut Beckers, Helge Willner (Bergische Univ. Wuppertal, Germany)
Pagep. 47


Session 4-2 
Time: 10:10 - 12:20 Saturday, April 5, 2014
Location: Multi-Purpose Studio (2F)
Chair: Weston Thatcher Borden (Univ. of North Texas, U.S.A.)

4-2-1 (Time: 10:10 - 10:30)
TitleModeling of Cysteine Thionitrate Intermediates by Taking Advantage of a Nano-Sized Molecular Cavity
Author*Kei Goto, Tsukasa Sano, Shohei Sase (Tokyo Inst. of Tech., Japan)
Pagep. 48

4-2-2 (Time: 10:30 - 10:50)
TitleExploring the Organometallic Chemistry of Heavy [1.1.1]Propellanes of Group 14
Author*Timo Augenstein, Dominik Nied, Frank Breher (Karlsruhe Inst. of Tech., Germany)
Pagep. 49

4-2-3 (Time: 10:50 - 11:20)
Title(Invited Talk) Configurationally Stable Pentaorganosilicates – Toward Chiral Silicates
Author*Koop Lammertsma (VU Univ. Amsterdam, Netherlands)
Pagep. 50

4-2-4 (Time: 11:20 - 11:50)
Title(Invited Talk) On the Presence of Hexacoordinate Hypervalent Carbon Species
Author*Kin-ya Akiba (Waseda Univ., Japan), Yohsuke Yamamoto (Hiroshima Univ., Japan), Hiromi Nakai (Waseda Univ., Japan)
Pagep. 51

4-2-5 (Time: 11:50 - 12:20)
Title(Invited Talk) Tunneling Control of Chemical Reactions
Author*Peter Richard Schreiner (Justus Liebig Univ., Germany)
Pagep. 52



Sunday, April 6, 2014

Session 5-1 
Time: 9:00 - 10:20 Sunday, April 6, 2014
Location: Multi-Purpose Studio (2F)
Chair: Koop Lammertsma (VU Univ. Amsterdam, Netherlands)

5-1-1 (Time: 9:00 - 9:30)
Title(Invited Talk) The Remarkable Properties of LiCB11Me12
AuthorMatibur Zamadar (Univ. of Colorado, U.S.A.), Jiří Kaleta (Academy of Sciences of the Czech Republic, Czech Republic), Victoria Volkis, Keith Whitener, Christos Douvris (Univ. of Colorado, U.S.A.), *Josef Michl (Univ. of Colorado/Academy of Sciences of the Czech Republic, U.S.A.)
Pagep. 53

5-1-2 (Time: 9:30 - 9:50)
TitleSome Photoreactive and Emissive Organoboron Compounds
Author*Shigehiro Yamaguchi (Nagoya Univ., Japan)
Pagep. 54

5-1-3 (Time: 9:50 - 10:20)
Title(Invited Talk) Synthesis and Structure of a Gallole Dianion Bearing a Bulky Aryl Substituent
AuthorTomohiro Agou, Tatsuya Wasano, *Norihiro Tokitoh (Kyoto Univ., Japan)
Pagep. 55


Session 5-2 
Time: 10:20 - 11:50 Sunday, April 6, 2014
Location: Multi-Purpose Studio (2F)
Chair: Manabu Abe (Hiroshima Univ., Japan)

5-2-1 (Time: 10:20 - 10:50)
Title(Invited Talk) Main Group Complexes with Unusual Donor-Acceptor Bonds
Author*Gernot Frenking (Philipps-Univ. Marburg, Germany)
Pagep. 56

5-2-2 (Time: 10:50 - 11:20)
Title(Invited Talk) The Boron-Nitrogen Derivative of ortho-Benzyne
Author*Holger F. Bettinger (Univ. of Tuebingen, Germany)
Pagep. 57

5-2-3 (Time: 11:20 - 11:50)
Title(Invited Talk) Stable Carbenes and Other Unusual Species
Author*Guy Bertrand (Univ. of California, San Diego, U.S.A.)
Pagep. 58



Thursday, April 3, 2014

Session P  Poster
Time: 17:30 - 19:30 Thursday, April 3, 2014
Location: Public Gallery (1F)

P-1
TitleMeso-Substituted Porphyrins for Porphyrin-Polyyne Wires
Author*Vroni Walter, Norbert Grzegorzek, Frank Hampel, Rik R. Tykwinski (Univ. of Erlangen-Nuremberg, Germany)
Pagep. 59

P-2
TitleCombining Petroleum Biomarkers – Investigation of Optically Active Steroid Derived Ni(II)-Porphyrin Dyads
Author*Matthias Schulze, Alexander Scherer, Frank Hampel (Univ. of Erlangen-Nuremberg, Germany), Jeffrey M. Stryker (Univ. of Alberta, Canada), Rik R. Tykwinski (Univ. of Erlangen-Nuremberg, Germany)
Pagep. 60

P-3
TitleCustom-Tailored Polyphenylenic Porphyrins via Diels-Alder Reaction
Author*Dominik Lungerich, Norbert Jux (Univ. of Erlangen, Germany)
Pagep. 61

P-4
TitleCleavage of Carbon-Carbon Triple Bond
Author*Noriko Okamoto, Reiko Yanada (Hiroshima International Univ., Japan)
Pagep. 62

P-5
TitleConstruction of Honeycomb Lattice Based on Molecular Crystals Aimed at Generation of Singular Two-Dimensional Electric Structures
Author*Takuya Kodama, Shogo Miyazaki, Tomohiko Nishiuchi, Yasukazu Hirao, Takashi Kubo (Osaka Univ., Japan)
Pagep. 63

P-6
TitleSyntheses and Supramolecular Structures of Open-Shell Molecular Crystals of Trinuclear Triple-Helicate for Spin Manipulation
Author*Hirofumi Nobukuni, Tsuyoshi Murata (Osaka Univ., Japan), Yasushi Morita (Osaka Univ., and JST CREST, Japan)
Pagep. 64

P-7
TitleSelf-Assembling Behaviors and Chiroptical Properties of Phenylisoxazolylbenzenes Possessing Luminophore
Author*Takeharu Haino, Midori Takayama, Tetsuya Masuda, Toshiaki Ikeda (Hiroshima Univ., Japan)
Pagep. 65

P-8
TitleStable and Flexible Hydrogen Atom Trapping Toward the Construction of PCET Stabilized Proton-Electron Mediator
Author*Mitsuru Teraoka, Yasukazu Hirao, Tomohiko Nishiuchi, Takashi Kubo (Osaka Univ., Japan)
Pagep. 66

P-9
TitleExcited State Intramolecular Proton Transfer of Schiff Bases in Triplet Surface
Author*Geethika K. Weragoda, Jennifer Grabo, Anna Ratliff, Michael J. Baldwin, Anna D. Gudmundsdottir (Univ. of Cincinnati, U.S.A.)
Pagep. 67

P-10
TitleSolid to Solid Photochemical di-Denitrogenation in Dancing Crystalline Solid
Author*Sujan Kumar Sarkar, Eliza Wilder, Anna D. Gudmundsdottir (Univ. of Cincinnati, U.S.A.)
Pagep. 68

P-11
TitleA Study on Photochemical [2+2] Cycloaddition of Allylamine Derivative
Author*Kengo Uchihashi, Manabu Abe (Hiroshima Univ., Japan)
Pagep. 69

P-12
TitleTriplet Carbenes and Quartet Nitreno Radicals: Matrix Isolation and Computational Studies
Author*Miguel Fernández-Oliva, Wolfram Sander (Ruhr Univ. Bochum, Germany), Elsa Sánchez-García (Max-Planck-Institut für Kohlenforschung, Germany)
Pagep. 70

P-13
TitleBenzyl Radical and Small Molecules, What Happens in the Ar Matrix?
Author*Kenny Bravo-Rodriguez (Max-Planck-Institut für Kohlenforschung, Germany), Saonli Roy, Wolfram Sander (Ruhr Univ. Bochum, Germany), Elsa Sanchez-Garcia (Max-Planck-Institut für Kohlenforschung, Germany)
Pagep. 71

P-14
TitleReaction of Triplet Phenylnitrene with Oxygen in Low-Temperature Matrices
Author*Joel Mieres-Pérez, Enrique Méndez-Vega, Wolfram Sander (Ruhr Univ. Bochum, Germany)
Pagep. 72

P-15
TitleOrganic Radicals from Metal Carbynes
Author*Arunlibertsen Lawzer (Ruhr Univ. Bochum, Germany), Ophir Levy (The Hebrew Univ. of Jerusalem, Israel), Wolfram Sander (Ruhr Univ. Bochum, Germany), Avi Bino (The Hebrew Univ. of Jerusalem, Israel)
Pagep. 73

P-16
TitleDesign of a Stable Carbonylvinylnitrene Diradical
Author*Tomáš Šolomek, Emilie Chalaye, Thomas Bally (Univ. of Fribourg, Switzerland)
Pagep. 74

P-17
TitleThe Fixation of Unstable Intermediates in KBr Matrix. IR and DFT Study
AuthorIvan Yurievich Kalagaev, Iosif Isaevich Grinvald (Nizhny Novgorod State Technical Univ. of R.E. Alekseev, Russian Federation), Alexander Nikolaevich Artemov (Nizhny Novgorod State Univ. of N.I. Lobachevski, Russian Federation), *Ivan Alexandrovich Spirin (Nizhny Novgorod State Technical Univ. of R.E. Alekseev, Russian Federation)
Pagep. 75

P-18
TitleSyntheses, Structures, and Reactivities of E=C=SVI Heteroallenes (E = SIV, SeIV)
Author*Tomohito Morosaki, Takayoshi Fujii (Nihon Univ., Japan)
Pagep. 76

P-19
TitleStructures of 3-(Diethylborylethynyl)pyridine in Solution and Crystalline State
Author*Shigeharu Wakabayashi, Aimi Kida, Iyo Nishimura, Seiji Komeda (Suzuka Univ. of Medical Science, Japan)
Pagep. 77

P-20
TitleMatrix Isolation of 2- and 6-Azulenylcarbene
Author*Stefan Henkel, Wolfram Sander (Ruhr Univ. Bochum, Germany)
Pagep. 78

P-21
Title"Septet 1,3,5-Trichloro-2,4,6-Trinitrenobenzene: A Stable High-Spin Nitrene in Low-Temperature Inert Gas Matrices"
Author*Enrique Méndez-Vega, Joel Mieres-Pérez, Wolfram Sander (Ruhr Univ. Bochum, Germany)
Pagep. 79

P-22
TitleTransition Metal Nitrosyl Complexes with the Hindered N3 Type Ligand
Author*Kiyoshi Fujisawa, Shoko Soma (Ibaraki Univ., Japan)
Pagep. 80

P-23
TitleTheoretical Study on the Formation of One-Electron σ Bond Associated with Dynamic Structural Changes upon Reduction of Bis(diarylboryl)biphenyl
Author*Eisuke Ohta, Kazuki Nishimura, Ryota Yokoyama (Osaka Prefecture Univ., Japan), Atsushi Wakamiya, Yasujiro Murata (Kyoto Univ., Japan), Hiroshi Ikeda (Osaka Prefecture Univ., Japan)
Pagep. 81

P-24
TitleAnalysis of “The Excited State C–C Bond Cleavage–Emission” Phenomenon of Methylenecyclopropanes by Using Laser Flash Photolysis
Author*Yasunori Matsui, Taiki Kido, Eisuke Ohta, Hiroshi Ikeda (Osaka Prefecture Univ., Japan)
Pagep. 82

P-25
TitleTrial Stabilization of Radical Cations Possessing “One-Electron σ Bond” Derived from the Cage-Type Compound
Author*Yutaro Kuramoto, Naoya Asada, Eisuke Ohta, Kazuhiko Mizuno, Hiroshi Ikeda (Osaka Prefecture Univ., Japan)
Pagep. 83

P-26
Title“The Excited State C–C Bond Cleavage–Emission” System of Methylenecyclopropanes Triggered by Intermolecular Energy Transfer
Author*Taiki Kido, Yasunori Matsui, Eisuke Ohta, Hiroshi Ikeda (Osaka Prefecture Univ., Japan)
Pagep. 84

P-27
TitleTheoretical Investigation of the Symmetric Intramolecular Charge Transfer Effects on the Diradical Character and Second Hyperpolarizability of Open-Shell Singlet Systems
Author*Kotaro Fukuda, Yuta Hirosaki, Shota Takamuku, Masayoshi Nakano (Osaka Univ., Japan)
Pagep. 85

P-28
TitleTheoretical Study on the Diradical Characters and Optical Response Properties of Open-Shell Chemical Species Involving Cyclopentane-1,3-Diradical Structures
Author*Ryohei Kishi, Yusuke Murata, Michika Saito, Kotaro Fukuda, Hiroshi Matsui, Shota Takamuku (Osaka Univ., Japan), Manabu Abe (Hiroshima Univ., Japan), Masayoshi Nakano (Osaka Univ., Japan)
Pagep. 86

P-29
TitleRelationship between Diradical Character and Second Hyperpolarizability of Four-Membered-Ring Compounds Involving Heavy Main Group Elements
Author*Hiroshi Matsui, Kotaro Fukuda, Yuta Hirosaki, Shota Takamuku, Masayoshi Nakano (Osaka Univ., Japan)
Pagep. 87

P-30
TitleStudy on Unusual Emission of Cyclopropane Derivatives
Author*Kousei Kanahara (Hiroshima Univ., Japan), Manabu Abe (Hiroshima Univ./Institute for Molecular Science, Japan)
Pagep. 88

P-31
TitleStereoselectivity in Ring-closing Reaction of Singlet Octahydropentalene-1,3-dilys
Author*Saori Tada (Hiroshima Univ., Japan), Manabu Abe (Hiroshima Univ./Institute for Molecular Science, Japan)
Pagep. 89

P-32
TitleStudy on Triplet - Singlet Intersystem Crossing of Cyclopentane-1,3-diyls
Author*Takemi Mizuno, Manabu Abe (Hiroshima Univ., Japan)
Pagep. 90

P-33
TitleSpin Multiplicity Change During the Ring-closing Reaction of the Cyclopentane-1,3-diradical with Nitroxide Radicals
Author*Sayaka Hatano, Yasuyuki Omokawa, Manabu Abe (Hiroshima Univ., Japan)
Pagep. 91

P-34
TitlePhotoreaction of 1,4-Dioxatrispiro[4.0.56.1.513.05]octadecan-12-one
Author*Asako Sawai, Manabu Abe (Hiroshima Univ., Japan)
Pagep. 92

P-35
TitleGeneration of 4,4-Dialkoxy-1,2-diazacyclopentane-3,5-diyls and Their Reactivity
Author*Shohei Yoshidomi, Manabu Abe (Hiroshima Univ., Japan)
Pagep. 93

P-36
TitleA Study on the Chemistry of Multi-Radical Species Embedded in Macrocyclic Rings
Author*Shunsuke Kumashiro (Hiroshima Univ., Japan), Manabu Abe (Hiroshima Univ./Institute for Molecular Science, Japan)
Pagep. 94

P-37
TitleDesign and Synthesis of New Stable Fluorenyl Radicals
Author*Yi Tian, Kazuyuki Uchida, Akihito Konishi, Tomohiko Nishiuchi, Yasukazu Hirao (Osaka Univ., Japan), Hiroyuki Kurata (Fukui Univ. of Tech., Japan), Takashi Kubo (Osaka Univ., Japan)
Pagep. 95

P-38
TitleDiradical Character Based Molecular Design for Singlet Fission in Heteroacenes
Author*Soichi Ito, Masayoshi Nakano (Osaka Univ., Japan)
Pagep. 96

P-39
TitleReactions of an Isolable Dialkylsilylene with Substituted Benzophenones
Author*Shintaro Ishida, Kenya Uchida, Takeaki Iwamoto (Tohoku Univ., Japan)
Pagep. 97

P-40
TitleObservation of New Xanthylidene Derivatives and the Substituent Effect on the 1,8-Positions
Author*Shun Sugawara, Yoshihisa Fujiwara, Manabu Abe, Yohsuke Yamamoto (Hiroshima Univ., Japan)
Pagep. 98

P-41
TitleChemistry of 3-(1a,9b-dihydro-1H-cyclopropa[l]phenanthren-1-yl)-2,2,4,4-tetramethylpentan-3-ol
AuthorJoseph D. DeAngelo, *Dasan M. Thamattoor (Colby College, U.S.A.)
Pagep. 99

P-42
TitleRose Bengal-Sensitized Disulfide Cross-Coupling: Mechanistic Considerations
Author*Peter Šebej, Lucie Ludvíková, Dominik Heger, Petr Klán (Masaryk Univ., Czech Republic)
Pagep. 100

P-43
TitleC-H Functionalization by Photo-Excited Ketone of Binaphthyl Derivatives
Author*Takaaki Tamura, Ryukichi Takagi, Manabu Abe (Hiroshima Univ., Japan)
Pagep. 101

P-44
TitleSynthetic Studies of Novel Trifluoromethyl Substituted Oxaziridines for Stereoselective C-H Functionalization
Author*Yuta Noguchi, Ryukichi Takagi (Hiroshima Univ., Japan), Manabu Abe (Hiroshima Univ./Institute for Molecular Science, Japan)
Pagep. 102

P-45
TitleGas-Phase Acidity of Polyfluorinated Cage-Hydrocarbon Derivatives: Experimental and Computational Studies
AuthorMin Zhang, Md. Mizanur Rahman Badal, Magdalena Pasikowska, *Takaaki Sonoda, Masaaki Mishima (Kyushu Univ., Japan), Haruhiko Fukaya, Taizo Ono (AIST, Japan), Hans-Ullrich Siehl (Ulm Univ., Germany), Jose-Louis M. Abboud (CSIC, Spain), Ilmar A. Koppel (Univ. of Tartu, Estonia)
Pagep. 103

P-46
TitleExperimental and Computational Studies on Conjugative Stabilization of Phenyl Cation Intermediates by Electron-Donating Meta-Substituents
AuthorMasayuki Harada, Ken-Ichi Hosoda, Hiroshi Kobayashi, Toshiyuki Nakatsuji, *Takaaki Sonoda (Kyushu Univ., Japan)
Pagep. 104