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FUJIHARA Seminar-70
International Symposium on New Development of Physical Organic Chemistry: Construction of Chemical Principles Determining Structures, Reactions, and Properties 70
Technical Program

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

Session Schedule


Sunday, April 17, 2016

Registration
16:50 - 18:05
Welcome Party
18:05 - 21:30

Monday, April 18, 2016

Opening
8:00 - 8:25
1-1
8:25 - 9:40
1-2
9:40 - 10:30
Coffee Break and Photo
10:30 - 10:55
1-3
10:55 - 12:35
Lunch
12:35 - 13:40
1-4
13:40 - 15:45
Coffee Break
15:45 - 16:10
1-5
16:10 - 18:40
Dinner
19:00 - 19:55
P  Poster
19:55 - 21:30

Tuesday, April 19, 2016

2-1
8:00 - 9:15
2-2
9:15 - 10:30
Coffee Break
10:30 - 10:55
2-3
10:55 - 12:35
Lunch
12:35 - 13:40
2-4
13:40 - 15:45
Coffee Break
15:45 - 16:10
2-5
16:10 - 18:15
Free Time
18:15 - 21:30

Wednesday, April 20, 2016

3-1
8:00 - 9:15
3-2
9:15 - 10:30
Coffee Break
10:30 - 10:55
3-3
10:55 - 12:35
Lunch
12:35 - 13:40
3-4
13:40 - 15:45
Coffee Break
15:45 - 16:10
3-5
16:10 - 17:25
3-6
17:25 - 18:40
Banquet
19:00 - 21:30


List of abstracts

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

Monday, April 18, 2016

Session 1-1 
Time: 8:25 - 9:40 Monday, April 18, 2016
Chair: Kazunari Yoshizawa (Kyushu Univ.)

1-1-1 (Time: 8:25 - 9:15)
Title(Plenary) Two New Games for Carbon, we Hope
Author*Roald Hoffmann (Cornell Univ., U.S.A.)
Pagepp. 1 - 2

1-1-2 (Time: 9:15 - 9:40)
TitleNovel Metallosilenyl Reagents and their Reactions
Author*Yitzhak Apeloig, Daniel Pinchuk, Dmitry Bravo-Zhivotovskii (Technion, Israel)
Pagepp. 3 - 4


Session 1-2 
Time: 9:40 - 10:30 Monday, April 18, 2016
Chair: Shigehiro Yamaguchi (Nagoya Univ.)

1-2-1 (Time: 9:40 - 10:05)
TitleWhat Is the Effect of the Replacement of CH2 by O on the Measured and Calculated Values of the Singlet-Triplet Energy Difference (ΔEST) in Trimethylenemethane (TMM) → Oxyallyl (OXA) → Dehydroacetic Acid (DHAA) → Carbon Trioxide (CO3)?
Author*Weston Thatcher Borden (Univ. of North Texas, U.S.A.), Xue-Bin Wang (Pacific Northwest National Laboratory, U.S.A.), Bo Chen (Univ. of North Texas, U.S.A.), Gao-Lei Hou (Pacific Northwest National Laboratory, U.S.A.), David A. Hrovat (Univ. of North Texas, U.S.A.)
Pagepp. 5 - 6

1-2-2 (Time: 10:05 - 10:30)
TitleToward Synthesis of Thermally Stable Triplet Carbenes
Author*Yohsuke Yamamoto, Junki Yamamoto, Shin-ichi Fuku-en (Hiroshima Univ., Japan), Ko Furukawa (Niigata Univ., Japan), Masayoshi Nakano (Osaka Univ., Japan)
Pagepp. 7 - 8


Session 1-3 
Time: 10:55 - 12:35 Monday, April 18, 2016
Chair: Leo Radom (Univ. of Sydney)

1-3-1 (Time: 10:55 - 11:20)
TitleQuantum Mechanical Tunneling Reactions of Organic Reactive Intermediates
Author*Robert McMahon (Univ. of Wisconsin-Madison, U.S.A.), Hiroshi Inui (Kitasato Univ., Japan)
Pagepp. 9 - 10

1-3-2 (Time: 11:20 - 11:45)
TitleMolecular Design for Long-lived Localized Diradicals (Biradicals)
AuthorKeita Onishi, Haruka Furunaga, *Manabu Abe (Hiroshima Univ., Japan)
Pagepp. 11 - 12

1-3-3 (Time: 11:45 - 12:10)
TitleOpen-Shell Character Based Design for Nonlinear Optical Molecular Systems
Author*Masayoshi Nakano (Osaka Univ., Japan)
Pagepp. 13 - 14

1-3-4 (Time: 12:10 - 12:35)
TitleSophisticated Photoresponsive System Made of Supramolecular Assembly of Photochromic Diarylethene at Two- and Three-Dimension
Author*Kenji Matsuda (Kyoto Univ., Japan)
Pagepp. 15 - 16


Session 1-4 
Time: 13:40 - 15:45 Monday, April 18, 2016
Chair: Yohsuke Yamamoto (Hiroshima Univ.)

1-4-1 (Time: 13:40 - 14:05)
TitleMechanism(s) of Ring Contraction in Carbenes and Nitrenes
Author*Curt Wentrup, David Kvaskoff (Univ. of Queensland, Australia)
Pagepp. 17 - 18

1-4-2 (Time: 14:05 - 14:30)
TitleRing Expansion of 1-Bromoalumole to 1-Bromoalumonin by Insertion of Two Alkyne Molecules into the Al–C Bonds
AuthorTomohiro Agou, Tatsuya Wasano, Takahiro Sasamori, Jing-Dong Guo, Shigeru Nagase, *Norihiro Tokitoh (Kyoto Univ., Japan)
Pagepp. 19 - 20

1-4-3 (Time: 14:30 - 14:55)
TitleNew Strategies to Achieve Photoactivation Using Visible Light
Author*Arthur Winter (Iowa State Univ., U.S.A.)
Pagepp. 21 - 22

1-4-4 (Time: 14:55 - 15:20)
TitleModeling of Cysteine-Derived Reactive Intermediates by Taking Advantage of Cavity-Shaped Molecular Cradles
Author*Kei Goto, Tsukasa Sano, Nozomu Watanabe, Shohei Sase (Tokyo Inst. of Tech., Japan)
Pagepp. 23 - 24

1-4-5 (Time: 15:20 - 15:45)
TitleThe Crystalline Sponge Method for Structure Determination
Author*Yasuhide Inokuma, Makoto Fujita (Univ. of Tokyo, Japan)
Pagepp. 25 - 26


Session 1-5 
Time: 16:10 - 18:40 Monday, April 18, 2016
Chair: Shigeru Yamago (Kyoto Univ.)

1-5-1 (Time: 16:10 - 16:35)
TitleCoarctate and Pseudocoarctate Reactions: Stereochemical Rules
Author*Rainer Herges (Kiel Univ., Germany)
Pagepp. 27 - 28

1-5-2 (Time: 16:35 - 17:00)
TitlePhosphorus-Containing Fluorophores for Bioimaging
AuthorAiko Fukazawa, Masayasu Taki, *Shigehiro Yamaguchi (Nagoya Univ., Japan)
Pagepp. 29 - 30

1-5-3 (Time: 17:00 - 17:25)
Titleπ-Conjugated Disilenes Stabilized by Bulky Rind Groups
Author*Tsukasa Matsuo (Kindai Univ., Japan)
Pagepp. 31 - 32

1-5-4 (Time: 17:25 - 17:50)
TitleQuantum Chemical Calculation of J(Si,C) Nuclear Spin-Spin Coupling Constants. A Tool for Investigation of Silicon Carbon Hyperconjugation and Hypercoordination in Carbocations
Author*Hans-Ullrich Siehl, Martin Holzschuh, Christoph Freudenberger, Philipp Huber (Ulm Univ., Germany)
Pagepp. 33 - 34

1-5-5 (Time: 17:50 - 18:15)
TitleStructure and Transformation of Strained Organosilicon Clusters
Author*Takeaki Iwamoto, Naohiko Akasaka, Shintaro Ishida (Tohoku Univ., Japan)
Pagepp. 35 - 36

1-5-6 (Time: 18:15 - 18:40)
TitleDynamic Interfaces: Controlling Thin Films and Fluid Emulsions for Sensing
Author*Timothy M. Swager (Massachusetts Inst. of Tech., U.S.A.)
Pagepp. 133 - 134



Tuesday, April 19, 2016

Session 2-1 
Time: 8:00 - 9:15 Tuesday, April 19, 2016
Chair: Weston Thatcher Borden (Univ. of North Texas)

2-1-1 (Time: 8:00 - 8:50)
Title(Plenary) Exploration of the Mechanism of Organic and Organometallic Reactions Using the Global Reaction Route Mapping (GRRM) Strategy
Author*Keiji Morokuma (Kyoto Univ., Japan)
Pagepp. 37 - 38

2-1-2 (Time: 8:50 - 9:15)
TitleCombining Cyclizations and Fragmentations in Stereoelectronically Guided Radical Cascades: from Radical Pools to Traceless Directing Groups
Author*Igor V. Alabugin (Florida State Univ., U.S.A.)
Pagepp. 39 - 40


Session 2-2 
Time: 9:15 - 10:30 Tuesday, April 19, 2016
Chair: Hiroyuki Furuta (Kyushu Univ.)

2-2-1 (Time: 9:15 - 9:40)
TitleSupramolecular Structures and Photoelectronic Properties of Inclusion Complexes Composed of Self-Assembling Cyclic Porphyrin Dimers and Fullerens
Author*Fumito Tani (Kyushu Univ., Japan)
Pagepp. 41 - 42

2-2-2 (Time: 9:40 - 10:05)
TitleIsolation of Species Hitherto Believed to Be Only Transient Intermediates
Author*Guy Bertrand (UC San Diego, U.S.A.)
Pagepp. 43 - 44

2-2-3 (Time: 10:05 - 10:30)
TitleOrganic Synthesis of Endohedral Fullerenes
Author*Yasujiro Murata (Kyoto Univ., Japan)
Pagepp. 45 - 46


Session 2-3 
Time: 10:55 - 12:35 Tuesday, April 19, 2016
Chair: Yoshito Tobe (Osaka Univ.)

2-3-1 (Time: 10:55 - 11:20)
TitleAbiological Self-Assembly: Predesigned Metallacycles and Metallacages via Coordination
Author*Peter J. Stang (Univ. of Utah)
Pagepp. 47 - 48

2-3-2 (Time: 11:20 - 11:45)
TitleSelf-Association Behaviors of Phenalenyl Radicals
Author*Takashi Kubo (Osaka Univ., Japan), Miklos Kertesz (Georgetown Univ., U.S.A.)
Pagepp. 49 - 50

2-3-3 (Time: 11:45 - 12:10)
TitleDevelopment of High-Efficiency Organic Light-Emitting Materials and Devices
Author*Takuma Yasuda (Kyushu Univ., Japan)
Pagepp. 51 - 52

2-3-4 (Time: 12:10 - 12:35)
TitleLocal Curvatures and Stability of Fullerenes, Carbon Nanotori, and Related Topologically Nontrivial Graphitic Structures
Author*Bih-Yaw Jin (National Taiwan Univ., Taiwan), Yuan-Jia Fan (Local Curvatures and Stability of Fullerenes, Carbon Nanotori, and Related Topologically Nontrivial Graphitic Structures, Taiwan)
Pagepp. 53 - 54


Session 2-4 
Time: 13:40 - 15:45 Tuesday, April 19, 2016
Chair: Masayoshi Nakano (Osaka Univ.)

2-4-1 (Time: 13:40 - 14:05)
TitleThe Influence of Thermodynamic and Polar Effects on Radical Stability and Reactivity
AuthorBun Chan (Univ. of Sydney, Australia), Christopher Easton (Australian National Univ., Australia), *Leo Radom (Univ. of Sydney, Australia)
Pagepp. 55 - 56

2-4-2 (Time: 14:05 - 14:30)
TitleIsotope Effect Calculations in the Supramolecular Age
Author*Ian Williams, Philippe Wilson (Univ. of Bath, U.K.)
Pagepp. 57 - 58

2-4-3 (Time: 14:30 - 14:55)
TitlePhotomechanical effect of naphthalene diimides having alkylamino side chains
Author*Kenta Goto, Yuki Matsunaga, Teruo Shinmyozu (Kyushu Univ., Japan)
Pagepp. 59 - 60

2-4-4 (Time: 14:55 - 15:20)
TitleControlling the Spin States of Carbenes via Hydrogen and Halogen Bonding
AuthorPaolo Costa, Stefan Henkel (Ruhr Univ. Bochum, Germany), Pandian Sokkar, Elsa Sanchez-Garcia (Max-Planck-Institut für Kohlenforschung, Germany), *Wolfram Sander (Ruhr Univ. Bochum, Germany)
Pagepp. 61 - 62

2-4-5 (Time: 15:20 - 15:45)
TitleMacrocyclic Oligoarylamines as Hole- and Spin-Containing Molecular Scaffolds
Author*Akihiro Ito (Kyoto Univ., Japan)
Pagepp. 63 - 64


Session 2-5 
Time: 16:10 - 18:15 Tuesday, April 19, 2016
Chair: Kenji Matsuda (Kyoto Univ.)

2-5-1 (Time: 16:10 - 16:35)
TitleDative bonding in main-group compounds
Author*Gernot Frenking (Philipps Univ. Marburg, Germany)
Pagepp. 65 - 66

2-5-2 (Time: 16:35 - 17:00)
TitlePhotoreaction of Push-Pull Type Quinoline Derivatives Accompanied with Emission Change
Author*Satoru Karasawa, Kazuteru Usui, Noboru Koga (Kyushu Univ., Japan)
Pagepp. 67 - 68

2-5-3 (Time: 17:00 - 17:25)
TitleRecent Topics on Orbital Rule for Single Molecular Conductance
Author*Tomofumi Tada (Tokyo Inst. of Tech., Japan), Kazunari Yoshizawa (Kyushu Univ., Japan)
Pagepp. 69 - 70

2-5-4 (Time: 17:25 - 17:50)
TitleStructure and Reactions of Ferrocenyl-substituted Chlorogermylenoid
Author*Takahiro Sasamori, Yuko Suzuki, Jing-Dong Guo, Shigeru Nagase, Norihiro Tokitoh (Kyoto Univ., Japan)
Pagepp. 71 - 72

2-5-5 (Time: 17:50 - 18:15)
TitleThe Reaction of Bu3P with Electrophilic Alkenes
AuthorMenahem Kaftory, Mark Botoshansky (Schulich Faculty of Chemistry, Technion, Israel), Masaaki Mishima (Kyushu Univ., Japan), Hatim Salim (Hebrew Univ., Israel), *Zvi Rappoport (Hebrew Univ.)
Pagepp. 73 - 74



Wednesday, April 20, 2016

Session 3-1 
Time: 8:00 - 9:15 Wednesday, April 20, 2016
Chair: Yitzhak Apeloig (Technion)

3-1-1 (Time: 8:00 - 8:50)
Title(Plenary) Thermal Hydrogen-atom Transfer From Methane: A Mechanistic Exercise
Author*Helmut Schwarz, Maria Schlangen (TU Berlin, Germany)
Pagepp. 75 - 76

3-1-2 (Time: 8:50 - 9:15)
TitleNew Smart Reagents in Chemistry - Oriented Electric Fields
Author*Sason Shaik (Hebrew Univ., Israel)
Pagepp. 77 - 78


Session 3-2 
Time: 9:15 - 10:30 Wednesday, April 20, 2016
Chair: Tsukasa Matsuo (Kinki Univ.)

3-2-1 (Time: 9:15 - 9:40)
TitleNaked Intermediates in Cisplatin Drug Chemistry: Gas Phase Reactivity and Spectroscopy
AuthorDavide Corinti (Univ. di Roma La Sapienza, Italy), Cecilia Coletti, Nazzareno Re (Univ. G. D’Annunzio, Italy), Barbara Chiavarino, Maria Elisa Crestoni, *Simonetta Fornarini (Univ. di Roma La Sapienza, Italy)
Pagepp. 79 - 80

3-2-2 (Time: 9:40 - 10:05)
TitleRadical Cations and Dications of Cycloparaphenylenes
Author*Shigeru Yamago (Kyoto Univ., Japan)
Pagepp. 81 - 82

3-2-3 (Time: 10:05 - 10:30)
TitleEnzyme-Activation through Ligand Binding
Author*John Richard (Univ. at Buffalo, U.S.A.)
Pagepp. 83 - 84


Session 3-3 
Time: 10:55 - 12:35 Wednesday, April 20, 2016
Chair: Fumito Tani (Kyushu Univ.)

3-3-1 (Time: 10:55 - 11:20)
TitleLondon Dispersion Effects in Molecular Chemistry – Reconsidering Steric Effects
Author*Peter Richard Schreiner (Justus Liebig Univ., Germany)
Pagepp. 85 - 86

3-3-2 (Time: 11:20 - 11:45)
TitleN-Confused Corroles: Novel Ligands for Higher Oxidation States of Metals
Author*Hiroyuki Furuta (Kyushu Univ., Japan)
Pagepp. 87 - 88

3-3-3 (Time: 11:45 - 12:10)
TitleReactivity of Unsymmetrical Diborane(4) toward Multiple Bond and Its Complicated Mechanism
Author*Makoto Yamashita, Hiroki Asakawa, Chiemi Kojima, Yuhei Katsuma (Chuo Univ., Japan), Ka Ho Lee, Zhenyang Lin (Hong Kong Univ. of Science and Tech., Hong Kong)
Pagepp. 89 - 90

3-3-4 (Time: 12:10 - 12:35)
TitleAdsorptive Reduction of Dimethyl Trisulfide from Japanese Sake by Supported Noble Metal Nanoparticles
AuthorHaruno Murayama, Yusuke Yamamoto, Takayuki Hasegawa, Misaki Tone (Kyushu Univ., Japan), Tamao Ishida (Tokyo Metropolitan Univ., Japan), Atusko Isogai, Tsutomu Fujii (National Research Institute of Brewing, Japan), Mitsutaka Okumura (Osaka Univ., Japan), Tadahiro Fujitani (AIST, Japan), Tesuo Honma (Japan Synchrotron Radiation Research Institute (JASRI/SPring-8), Japan), *Makoto Tokunaga (Kyushu Univ., Japan)
Pagepp. 91 - 92


Session 3-4 
Time: 13:40 - 15:45 Wednesday, April 20, 2016
Chair: Manabu Abe (Hiroshima Univ.)

3-4-1 (Time: 13:40 - 14:05)
TitleDirect Alkylation of Gold Surface with Solutions of Organometallics
AuthorEva Kaletova, Jiri Kaleta, Guillaume Bastien, Katarina Varga, Martina Cizkova, Monika Benkovicova, Milan Masat, Anna Kohutova, Jan Hajduch (Institute of Organic Chemistry and Biochemistry, Czech Republic), Zdenek Bastl, Lubomir Pospisil (J. Heyrovský Institute of Physical Chemistry, Czech Republic), Ivan Stibor (Technical Univ. of Liberec, Czech Republic), Thomas F. Magnera (Univ. of Colorado, Boulder, U.S.A.), *Josef Michl (Univ. of Colorado, USA, and Institute of Organic Chemistry and Biochemistry, Czech Republic)
Pagepp. 93 - 94

3-4-2 (Time: 14:05 - 14:30)
TitleIndenofluorene Motifs in Singlet Diradicaloids and Tetraradicaloids
Author*Yoshito Tobe (Osaka Univ., Japan)
Pagepp. 95 - 96

3-4-3 (Time: 14:30 - 14:55)
TitleFrom Open-shell Singlet Diradicaloids to Polyradicaloids
Author*Jishan Wu (National Univ. of Singapore, Singapore)
Pagepp. 97 - 98

3-4-4 (Time: 14:55 - 15:20)
TitleThe Use of Carbon Nanotube Confinement to Tune Electronic Properties of π Conjugated Oligomer Guests
Author*Takashi Yumura, Hiroki Yamashita (Kyoto Inst. of Tech., Japan)
Pagepp. 99 - 100

3-4-5 (Time: 15:20 - 15:45)
TitlePrecise Design of Soft Interfaces through Polyelectrolyte Brush Immobilization
Author*Atsushi Takahara, Yuji Higaki (Kyushu Univ., Japan)
Pagepp. 101 - 102


Session 3-5 
Time: 16:10 - 17:25 Wednesday, April 20, 2016
Chair: Hideo Nagashima (Kyushu Univ.)

3-5-1 (Time: 16:10 - 16:35)
TitleComplex Systems Consisting of Transition Metal and Heavy Main Group Elements: Theoretical Study of Structure and Bonding Nature
Author*Shigeyoshi Sakaki (Kyoto Univ., Japan)
Pagepp. 103 - 104

3-5-2 (Time: 16:35 - 17:00)
TitleE-Field Triggered Single-Molecule Switches
Author*Marcel Mayor, Gero D. Harzmann (Univ. of Basel, Switzerland), Michal Valášek (Karlsruhe Inst. of Tech., Germany), Riccardo Frisenda (Delft Univ. of Tech., Netherlands), Kevin Edelmann, Lukas Gerhard, Wulf Wulfhekel (Karlsruhe Inst. of Tech., Germany), Herre S. J. van der Zant (Delft Univ. of Tech., Netherlands)
Pagepp. 105 - 106

3-5-3 (Time: 17:00 - 17:25)
TitleMechanistic Changes in Solvolysis Reactions
Author*Herbert Mayr (Ludwig-Maximilians-Univ. Muenchen, Germany)
Pagepp. 107 - 108


Session 3-6 
Time: 17:25 - 18:40 Wednesday, April 20, 2016
Chair: Yasujiro Murata (Kyoto Univ.)

3-6-1 (Time: 17:25 - 17:50)
TitlePalladium-Catalyzed Direct Arylation Polymerization (DArP) To Give π-Conjugated Polymers: Scope and Mechanism
Author*Fumiyuki Ozawa, Masayuki Wakioka (Kyoto Univ., Japan)
Pagepp. 109 - 110

3-6-2 (Time: 17:50 - 18:15)
TitleNew Iron and Ruthenium Catalysts for Hydrogenation of Alkenes
AuthorYusuke Sunada, Atsushi Tahara, *Hideo Nagashima (Kyushu Univ., Japan)
Pagepp. 111 - 112

3-6-3 (Time: 18:15 - 18:40)
TitlePolyarene Bowls, Baskets, Balls, Sheets, and Tubes
Author*Lawrence T. Scott (Boston College, U.S.A.)
Pagepp. 113 - 114



Monday, April 18, 2016

Session P  Poster
Time: 19:55 - 21:30 Monday, April 18, 2016

P-1
TitleComputational Investigation into Mechanisms for Cyclocondensation of Fluoroaromatics Promoted by Protons and Silyl Cations
Author*Takaaki Sonoda (UAP Owl Association, Japan), Naoto Suzuki, Takeshi Fujita, Junji Ichikawa (Univ. of Tsukuba, Japan), Daniel Himmel, Ingo Krossing (Freiburg Univ., Germany)
Pagepp. 115 - 116

P-2
TitleBiomimetic complexes for [NiFe] hydrogenase and prostaglandin endoperoxide H synthases (PGHSs): a density functional theory and artificial force-induced reaction method study
Author*W. M. C. Sameera, Keiji Morokuma (Kyoto Univ., Japan)
Pagepp. 117 - 118

P-3
TitleSubstituent Effects on Acidity of Aryl-substituted Fluoroalkanes. A Computational Study
Author*Masaaki Mishima, José-Luis M. Abboud (Kyushu Univ., Japan)
Pagepp. 119 - 120

P-4
Title1,2-Di(1-pyrenyl)disilene with Bulky Rind Groups
Author*Naoki Hayakawa, Tsukasa Matsuo (Kindai Univ., Japan)
Pagep. 121

P-5
TitleCatalytic Mechanism of Nitrogen Fixation by Dimolybdenum Complexes
Author*Hiromasa Tanaka (Kyushu Univ., Japan), Yoshiaki Nishibayashi (Univ. of Tokyo, Japan), Kazunari Yoshizawa (Kyushu Univ., Japan)
Pagep. 123

P-6
TitleMolecular Understanding of the Mechanism of Adhesion: From Epoxy Resin to Biological Recognition
Author*Kazunari Yoshizawa, Hiroyuki Murata, Chisa Higuchi, Takayuki Semoto, Hiromasa Tanaka (Kyushu Univ., Japan)
Pagepp. 125 - 126

P-7
TitleWhere Chemistry Meets Art: An Exploration of Nano World Through Mathematical Beading
AuthorBih-Yaw Jin (National Taiwan Univ., Taiwan), *Chia-Chin Tsoo (National Center for High-Performance Computing, Taiwan)
Pagepp. 127 - 128

P-8
TitleDevelopment of Conformational Search Program with Semiempirical Quantum Mechanical Calculations: Application to Enantioselective Organocatalysis
Author*Takashi Kamachi, Kazunari Yoshizawa (Kyushu Univ., Japan)
Pagepp. 129 - 130

P-9
TitleQua ntification of the Nucleophilic Reactivity of Nicotine
AuthorPeter A. Byrne, *Shinjiro Kobayashi (Ludwig-Maximilians-Univ. München, Germany), Martin Breugst (Univ. zu Köln, Germany), Hans Laub, Herbert Mayr (Ludwig-Maximilians-Univ. München, Germany)
Pagepp. 131 - 132