Atnaujinkite slapukų nuostatas

Quantum-Chemical Calculations of Molecular Systems as the Basis of Nanotechnologies in Applied Quantum Chemistry: Volume 6 [Kietas viršelis]

Edited by , Edited by
  • Formatas: Hardback, aukštis x plotis: 260x180 mm, weight: 1002 g, Illustrations
  • Išleidimo metai: 01-Mar-2012
  • Leidėjas: Nova Science Publishers Inc
  • ISBN-10: 1614708851
  • ISBN-13: 9781614708858
Kitos knygos pagal šią temą:
Quantum-Chemical Calculations of Molecular Systems as the Basis of Nanotechnologies in Applied Quantum Chemistry: Volume 6Didesnis paveikslėlis
  • Formatas: Hardback, aukštis x plotis: 260x180 mm, weight: 1002 g, Illustrations
  • Išleidimo metai: 01-Mar-2012
  • Leidėjas: Nova Science Publishers Inc
  • ISBN-10: 1614708851
  • ISBN-13: 9781614708858
Kitos knygos pagal šią temą:
Pastovi nuoroda: https://www.kriso.lt/db/9781614708858.html
Raktažodžiai:
Preface xi
Part I Quantum-Chemical Calculation of Chemical Compounds, Synthesized by Laureates of Nobel Prize
1(20)
Chapter 1 Research of Geometrical and Electronic Structure of the Molecule of Papaverine by Method Ab Initio (The Nobel Prize 1947, Robert Robertson)
3(6)
V. A. Babkin
D. S. Andreev
V. S. Belousova
Chapter 2 Research of Geometrical and Electronic Structure of the Molecule of Lysergic Acid by Method MNDO (The Nobel Prize, Woodward R.B., 1965)
9(6)
V. A. Babkin
D. S. Andreev
V. S. Belousova
Chapter 3 Research of Geometrical and Electronic Structure of the Molecule of a-glucose by Method MNDO (The Nobel Prize 1902, Fischer Emil)
15(6)
V. A. Babkin
D. S. Andreev
E. S. Titova
Part II Quantum Chemical Calculation of Liquid Crystal
21(14)
Chapter 4 Research of Geometrical and Electronic Structure of Molecule of Smectic Liquid Crystal Erephthalbis(Para-Butylaniline) by Method MNDO
23(6)
V. A. Babkin
D. S. Andreev
E. S. Titova
Chapter 5 Research of Geometrical and Electronic Structure of Molecule of Smectic Liquid Crystal Terephthalbis(Para-Butylaniline) by Method Ab Initio
29(6)
V. A. Babkin
D. S. Andreev
Part III Quantum Chemical Calculation of Cellulose
35(10)
Chapter 6 Estimation of Acid Force of Components of Synthesis 5-Acetyloxymethyl- 2-Chlorine-5- Ethyl-1,2,3-Dioxaphosphorynane
37(8)
V. A. Babkn
V. Yu. Dmitriev
G. A. Savin
E. S. Titova
G. E. Zaikov
Part IV Quantum Chemical Calculation of Oil Products
45(14)
Chapter 7 Estimation of Acid Force of 6-Methyperhydrotetralene
47(6)
V. A. Babkin
R. G. Fedunov
A. A. Ostrouxov
A. V. Kudryashov
E. S. Titova
Chapter 8 Estimation of Acid Force of 7-Methyperhydrotetralene
53(6)
V. A. Babkin
R. G. Fedunov
A. A. Ostrouxov
A. V. Kudryashov
E. S. Titova
Part V Quantum-Chemical Calculations in Biochemistry
59(14)
Chapter 9 About the Geometrical and Electronic Structure of Monoaminocarboxylic Acids
61(12)
V. A. Babkin
A. I. Rakhimov
A. V. Tsykanov
E. S. Titova
O. P. Buzinova
G. E. Zaikov
Part VI Quantum Chemical Calculation of Branchy Olefins
73(18)
Chapter 10 Research of Geometrical and Electronic Structure of Molecules of Monomers of Cationic Polymerization Branched out in B-Position in Relation to Double Bond by Method Ab Initio
75(8)
V. A. Babkin
V. V. Galenkin
E. S. Titova
Chapter 11 Research of Geometrical and Electronic Structure of Molecules of Monomers of Cationic Polymerization Branched out in B-Position in Relation to Double Bond by Method MNDO
83(8)
V. A. Babkin
V. V. Galenkin
E. S. Titova
Part VII Quantum-Chemical Calculation of Alicyclic Olefins of Cation Polymerization, Diolefins and Them Derivations
91(62)
Chapter 12 Research of Geometrical and Electronic Structure of Molecule Cyclohexene by Method MNDO
93(6)
V. A. Babkin
A. B. Abduraimov
Chapter 13 Research of Geometrical and Electronic Structure of Molecule 3-Methylcyclohexene by Method MNDO
99(6)
V. A. Babkin
A. B. Abduraimov
Chapter 14 Research of Geometrical and Electronic Structure of Molecule Methylenecyclohexane by Method MNDO
105(6)
V. A. Babkin
A. B. Abduraimov
Chapter 15 Research of Geometrical and Electronic Structure of Molecule Allylcyclopentane by Method MNDO
111(6)
V. A. Babkin
A. B. Abduraimov
Chapter 16 Research of Geometrical and Electronic Structure of Molecule 4-Methylmethylenecyclohexane by Method MNDO
117(6)
V. A. Babkin
A. B. Abduraimov
Chapter 17 Research of Geometrical and Electronic Structure of Molecule 3-Methylmethylenecyclohexane by Method MNDO
123(6)
V. A. Babkin
A. B. Abduraimov
Chapter 18 Research of Geometrical and Electronic Structure of Molecule 3-Vinylcyclopentene by Method MNDO
129(6)
V. A. Babkin
A. B. Abduraimov
Chapter 19 Research of Geometrical and Electronic Structure of Molecule 3-Allylcyclopentene by Method MNDO
135(6)
V. A. Babkin
A. B. Abduraimov
Chapter 20 Research of Geometrical and Electronic Structure of Molecule 2-Methylmethylenecyclohexane by Method MNDO
141(6)
V. A. Babkin
A. B. Abduraimov
Chapter 21 Research Geometrical and Electronic Structure Molecule 1-Methylcyclohexene by Method MNDO
147(6)
V. A. Babkin
A. B. Abduraimov
Part VIII Cyclic Conjugate Dienes
153(38)
Chapter 22 Research of Geometrical and Electronic Structure of Molecule 2,3-Dimethyl-1,3-Cyclopentadiene by Method MNDO
155(6)
V. A. Babkin
N. A. Azaryan
Chapter 23 Research Geometrical and Electronic Structure of Molecule 1,3-Dimethyl-1,3-Cyclopentadiene by Method MNDO
161(6)
V. A. Babkin
N. A. Azaryan
Chapter 24 Research Geometrical and Electronic Structure of Molecule 2-Methyl-1,3-Cyclopentadiene by Method MNDO
167(6)
V. A. Babkin
N. A. Azaryan
Chapter 25 Research of Geometrical and Electronic Structure of Molecule 2,3-Dimethyl-1,3-Cyclopenadiene by Method Ab Initio
173(6)
V. A. Babkin
D. S. Andreev
Chapter 26 Research of Geometrical and Electronic Structure of Molecule 1,3-Dimethyl-1,3-Cyclopenadiene by Method Ab Initio
179(6)
V. A. Babkin
D. S. Andreev
Chapter 27 Research of Geometrical and Electronic Structure of Molecule 2-Methyl-1,3-Cyclopenadiene by Method Ab Initio
185(6)
V. A. Babkin
D. S. Andreev
Part IX Compound with Small Cyclies
191(62)
Chapter 28 Research of Geometrical and Electronic Structure of Molecule 2,4-Spiroheptane by Method MNDO
193(6)
V. A. Babkin
S. M. Shamin
Chapter 29 Research of Geometrical and Electronic Structure of Molecule Spiropentane by Method MNDO
199(6)
V. A. Babkin
S. M. Shamin
Chapter 30 Research Geometrical and Electronic Structure of Molecule 1-Methylbicyclo [ 6, 1, 0] Nonane by Method MNDO
205(6)
V. A. Babkin
S. M. Shamin
Chapter 31 Research of Geometrical and Electronic Structure of Molecule 2,6-Spirononane by Method Ab Initio
211(6)
V. A. Babkin
D. S. Andreev
Chapter 32 Research of Geometrical and Electronic Structure of Molecule 2,5-Spirooctane by Method Ab Initio
217(6)
V. A. Babkin
D. S. Andreev
Chapter 33 Research of Geometrical and Electronic Structure of Molecule 1-Methylbicyclo [ 6,1,0]Nonane by Method Ab Initio
223(6)
V. A. Babkin
D. S. Andreev
Chapter 34 Research of Geometrical and Electronic Structure of Molecule 1-Methylbicyclo [ 6,1,0]Octane by Method Ab Initio
229(6)
V. A. Babkin
D. S. Andreev
Chapter 35 Research of Geometrical and Electronic Structure of Molecule 3-Methylbicyclo [ 4,1,0] Heptane by Method Ab Initio
235(6)
V. A. Babkin
D. S. Andreev
Chapter 36 Research of Geometrical and Electronic Structure of Molecule 2-Methylbicyclo [ 4,1,0] Heptane by Method Ab Initio
241(6)
V. A. Babkin
D. S. Andreev
Chapter 37 Research of Geometrical and Electronic Structure of Molecule 8,8-Dichlorinebicyclo [ 5,1,0] Octane by Method Ab Initio
247(6)
V. A. Babkin
D. S. Andreev
Part X Styrene and its Derivations
253(92)
Chapter 38 Research of Geometrical and Electronic Structure of Molecule Para-Methylstyrene by Method MNDO
255(6)
V. A. Babkin
E. A. Kologrivko
Chapter 39 Research of Geometrical and Electronic Structure of Molecule Styrene by Method MNDO
261(6)
V. A. Babkin
E. A. Kologrivko
Chapter 40 Research of Geometrical and Electronic Structure of Molecule 2,5-Dichlorostyrene by Method MNDO
267(6)
V. A. Babkin
K. S. Medvedeva
Chapter 41 Research of Geometrical and Electronic Structure of Molecule 3,4-Dichlorostyrene by Method MNDO
273(6)
V. A. Babkin
K. S. Medvedeva
Chapter 42 Research of Geometrical and Electronic Structure of Molecule Meta - Chlorostyrene by Method MNDO
279(6)
V. A. Babkin
K. S. Medvedeva
Chapter 43 Research Geometrical and Electronic Structure of Molecule Orto-Chlorostyrene by Method MNDO
285(6)
V. A. Babkin
K. S. Medvedeva
Chapter 44 Research Geometrical and Electronic Structure of Molecule Para-Chlorostyrene by Method MNDO
291(6)
V. A. Babkin
K. S. Medvedeva
Chapter 45 Research of Geometrical and Electronic Structure of Molecule 2-Isopropyl-5-Methylstyrene by Method Ab Initio
297(6)
V. A. Babkin
D. S. Andreev
Chapter 46 Research Geometrical and Electronic Structure of Molecule 5-Isopropyl-2-Methylstyrene by Method Ab Initio
303(6)
V. A. Babkin
D. S. Andreev
Chapter 47 Research of Geometrical and Electronic Structure of Molecule 2,4-Dimethylstyrene by Method Ab Initio
309(6)
V. A. Babkin
D. S. Andreev
Chapter 48 Research of Geometrical and Electronic Structure of Molecule O-Isopropylstyrene by Method Ab Initio
315(6)
V. A. Babkin
D. S. Andreev
Chapter 49 Research of Geometrical and Electronic Structure of Molecule O-Methylstyrene by Method Ab Initio
321(6)
V. A. Babkin
D. S. Andreev
Chapter 50 Research of Geometrical and Electronic Structure of Molecule P-Tret-Butylstyrene by Method Ab Initio
327(6)
V. A. Babkin
D. S. Andreev
Chapter 51 Research of Geometrical and Electronic Structure of Molecule 2-Methyl-4-Methoxy-5-Isopropylstyrene by Method Ab Initio
333(6)
V. A. Babkin
D. S. Andreev
Chapter 52 Research of Geometrical and Electronic Structure of Molecule A,P-Dimethylstyrene by Method Ab Initio
339(6)
V. A. Babkin
D. S. Andreev
Part XI Indene and Its Derivations
345(68)
Chapter 53 Research of Geometrical and Electronic Structure of Molecule 4,7-Dimethylindene by Method MNDO
347(6)
V. A. Babkin
D. M. Kolmak
Chapter 54 Research of Geometrical and Electronic Structure of Molecule 2-Methylindene by Method MNDO
353(6)
V. A. Babkin
D. M. Kolmak
Chapter 55 Research of Geometrical and Electronic Structure of Molecule 1-Methylindene by Method MNDO
359(6)
V. A. Babkin
D. M. Kolmak
Chapter 56 Research of Geometrical and Electronic Structure of Molecule Indene by Method MNDO
365(6)
V. A. Babkin
D. M. Kolmak
Chapter 57 Research of Geometrical and Electronic Structure of Molecule 1,3-Diphenylindene by Method MNDO
371(6)
V. A. Babkin
K. N. Sadukov
Chapter 58 Research of Geometrical and Electronic Structure of Molecule 1-Phenylindene by Method MNDO
377(6)
V. A. Babkin
K. N. Sadukov
Chapter 59 Research of Geometrical and Electronic Structure of Molecule 5-Vinylindene by Method MNDO
383(6)
V. A. Babkin
K. N. Sadukov
Chapter 60 Research of Geometrical and Electronic Structure of Molecule 7-Methylindene by Method Ab Initio
389(6)
V. A. Babkin
D. S. Andreev
Chapter 61 Research of Geometrical and Electronic Structure of Molecule 6-Methylindene by Method Ab Initio
395(6)
V. A. Babkin
D. S. Andreev
Chapter 62 Research of Geometrical and Electronic Structure of Molecule 5-Methylindene by Method Ab Initio
401(6)
V. A. Babkin
D. S. Andreev
Chapter 63 Research of Geometrical and Electronic Structure of Molecule 3-Methylindene by Method Ab Initio
407(6)
V. A. Babkin
D. S. Andreev
Part XII Aromatic Olefins
413(26)
Chapter 64 Research of Geometrical and Electronic Structure of Molecule O-Methoxyallylbenzol by Method MNDO
415(6)
V. A. Babkin
D. V. Jukov
Chapter 65 Research of Geometrical and Electronic Structure of Molecule P-Methoxyallylbenzol by Method MNDO
421(6)
V. A. Babkin
D. V. Jukov
Chapter 66 Research of Geometrical and Electronic Structure of Molecule 3-Phenylbutene-1 by Method MNDO
427(6)
V. A. Babkin
D. V. Jukov
E. S. Titova
Chapter 67 Research of Geometrical and Electronic Structure of Molecule Allyltoluene by Method MNDO
433(6)
V. A. Babkin
D. V. Jukov
E. S. Titova
About the Editors 439(2)
Index 441