Table of Contents: Part I. Quantum-chemical calculation of chemical compounds, synthesized by laureates of Nobel Prize, pp. 1
1. Geometrical and electronic structure of molecule terpene-menthol by method AB INITIO, pp. 3-5
(V.A. Babkin, А.V. Tsykanov, G.E. Zaikov)
2. Geometrical and electronic structure of molecule ammonia by method AB INITIO, pp. 7-9
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
3. Geometrical and electronic structure of molecule α-terpinol by method MNDO, pp. 11-13
(V.A. Babkin, А.V. Tsykanov)
Part II. Quantum-chemical calculation of cellulose, pp. 15
4. Geometrical and electronic structure of molecule dinitrocellulose by method MNDO, pp. 17-20
(V.A. Babkin, А.В. Tsykanov)
Part III. Quantum-chemical calculation of medical products, pp. 21
5. Geometrical and electronic structure of molecule acetyl chloride by method MNDO, pp. 23-24
(V.A. Babkin, V.Yu. Dmitriev)
6. Geometrical and electronic structure of molecule 4-methyl-2,6,7,3-oxa-1-fosfabicyclo[2,2,2]octane by method MNDO, pp. 25-27
(V.A. Babkin, V.Yu. Dmitriev)
Part IV. Quantum-chemical calculation of jet engine fuels, pp. 29
7. Geometrical and electronic structure of molecule dimethylhydrazine by method AB INITIO, pp. 31-33
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
8. Geometrical and electronic structure of molecule hydrogen peroxide by method AB INITIO, pp. 35-36
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
Part V. Quantum-chemical calculation in biochemistry, pp. 37
9. Geometrical and electronic structure of molecule adenine by method AB INITIO, pp. 39-42
(V.A. Babkin, V.Yu. Dmitriev, E.S. Titova., G.E. Zaikov)
10. Geometrical and electronic structure of molecule guanine by method AB INITIO, pp. 43-46
(V.A. Babkin, V.Yu. Dmitriev, E.S. Titova., G.E. Zaikov)
Part VI. Quantum-chemical calculation of linear olefins of cationic polymerization by method AB INITIO, pp. 47
11. Geometrical and electronic structure of molecule dekene-1 by method AB INITIO, pp. 49-52
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
12. Geometrical and electronic structure of molecule nonene-1 by method AB INITIO, pp. 53-56
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
13. Geometrical and electronic structure of molecule octene-1 by method AB INITIO, pp. 57-60
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
Part VII. Quantum-chemical calculation of linear olefins by method MNDO, pp. 61
14. Geometrical and electronic structure of molecule dekene-1 by method MNDO, pp. 63-65
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
15. Geometrical and electronic structure of molecule nonene-1 by method MNDO, pp. 67-69
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
16. Geometrical and electronic structure of molecule octene-1 by method MNDO, pp. 71-73
(V.A. Babkin, V.Yu. Dmitriev, G.E. Zaikov)
Part VIII. Quantum-chemical calculation of linear olefins of cationic polymerization, branched out in α-position in relation to double bond by method AB INITIO, pp. 75
17. Geometrical and electronic structure of molecule 3-methylpentene-1 by method AB INITIO, pp. 77-79
(V. A. Babkin, V. V. Galenkin)
Part IX. Quantum-chemical calculation of linear monomers, branched out in α-position in relation to double bond by method MNDO, pp. 81
18. Geometrical and electronic structure of molecule 3-methylpentene-1 by method MNDO, pp. 83-85
(V. A. Babkin, V. V. Galenkin)
Part X. Quantum-chemical calculation of linear monomers, branched out in γ-, δ –, ε-position in relation to double bond by AB INITIO, pp. 87
19. Geometrical and electronic structure of molecule 5-methylhexene-1 by method AB INITIO, pp. 89-92
(V.A. Babkin, D.S. Andreev)
20. Geometrical and electronic structure of molecule 5-methylheptene-1 by method AB INITIO, pp. 93-96
(V.A. Babkin, D.S. Andreev)
21. Geometrical and electronic structure of molecule 6-methylheptene-1 by method AB INITIO, pp. 97-100
(V.A. Babkin, D.S. Andreev)
Part XI. Quantum-chemical calculation of isoolefins by method AB INITIO, pp. 101
22. Geometrical and electronic structure of molecule 2-ethylebutene-1 by method AB INITIO, pp. 103-106
(V.A. Babkin, D.S. Andreev)
23. Geometrical and electronic structure of molecule 2,3-dimethylbutene-1 by method AB INITIO, pp. 107-110
(V.A. Babkin, D.S. Andreev)
Part XII. Quantum-chemical calculation of isoolefins by method MNDO, pp. 111
24. Geometrical and electronic structure of molecule 2-ethylebutene-1 by method MNDO, pp. 113-115
(V.A. Babkin, D.S. Andreev)
25. Geometrical and electronic structure of molecule 2,3-dimethylbutene-1 by method MNDO, pp. 117-119
(V.A. Babkin, D.S. Andreev)
Part XIII. Quantum-chemical calculation of dienes and trienes by method AB INITIO, pp. 121
26. Geometrical and electronic structure of molecule trans-3-methylpentadiene-1,3 by method AB INITIO, pp. 123-126
(V.A. Babkin, D.S. Andreev)
27. Geometrical and electronic structure of molecule cis-3-methylpentadiene-1,3 by method AB INITIO, pp. 127-130
(V.A. Babkin, D.S. Andreev)
28. Geometrical and electronic structure of molecule 4-methylpentadiene-1,3 by method AB INITIO, pp. 131-134
(V.A. Babkin, D.S. Andreev)
29. Geometrical and electronic structure of molecule 2,4-dimethylpentadiene-1,3 by method AB INITIO, pp. 135-138
(V.A. Babkin, D.S. Andreev)
30. Geometrical and electronic structure of molecule 1,1,4,4-tetramethylbutadiene-1,3 by method AB INITIO, pp. 139-142
(V.A. Babkin, D.S. Andreev)
31. Geometrical and electronic structure of molecule mircen by method AB INITIO., pp. 143-146
(V.A. Babkin, D.S. Andreev)
Part XIV. Quantum-chemical calculation of dienes and trienes by method MNDO, pp. 147
32. Geometrical and electronic structure of molecule cis-3-methylpentadiene-1,3 by method MNDO, pp. 149-151
(V.A. Babkin, D.S. Andreev)
33. Geometrical and electronic structure of molecule 4-methylpentadiene-1,3 by method MNDO, pp. 153-155
(V.A. Babkin, D.S. Andreev)
34. Geometrical and electronic structure of molecule 1,1,4,4-tetramethylbutadiene-1,3 by method MNDO, pp. 157-159
(V.A. Babkin, D.S. Andreev)
35. Geometrical and electronic structure of molecule mircen by method MNDO, pp. 161-163
(V.A. Babkin, D.S. Andreev)
36. Geometrical and electronic structure of molecule 2-phenylbutadiene-1,3 by method MNDO, pp. 165-167
(V.A. Babkin, D.S. Andreev)
Part XV. Styrene and its derivations, pp. 169
37. Geometrical and electronic structure of molecule trans-p-metoxi-β-methystyrene by method MNDO, pp. 171-173
(V.A. Babkin, D.S. Andreev)
38. Geometrical and electronic structure of molecule cis-β-n-propilstyrene by method MNDO, pp. 175-177
(V.A. Babkin, D.S. Andreev)
39. Geometrical and electronic structure of molecule cis-p-etoxi-β-methylstyrene by method MNDO, pp. 179-181
(V.A. Babkin, D.S. Andreev)
40. Geometrical and electronic structure of molecule trans-p-etoxi-β-methylstyrene by method MNDO, pp. 183-185
(V.A. Babkin, D.S. Andreev)
Part XVI. Indene and its его derivations, pp. 187
41. Geometrical and electronic structure of molecule 1,4 -(1,1´-diindenyl)trans-butene-2 by method MNDO, pp. 189-191
(V.A. Babkin, I.N. Kozlov)
42. Geometrical and electronic structure of molecule 1,2 -(3,3´-diindenyl)butan by method MNDO, pp. 193-196
(V.A. Babkin, I.N. Kozlov)
43. Geometrical and electronic structure of molecule 1,2-(3,3´-diindenyl)etan by method MNDO, pp. 197-200
(V.A. Babkin, I.N. Kozlov)
Part XVII. Bicyclic olefins, pp. 201
44. Geometrical and electronic structure of molecule 2-(bicyclo[2,2,1]heptan)propene by method AB INITIO, pp. 203-206
(V.A. Babkin, D.S. Andreev)
45. Geometrical and electronic structure of molecule 2-vinilbicyclo[2,2,1]heptan by method AB INITIO, pp. 207-210
(V.A. Babkin, D.S. Andreev)
46. Geometrical and electronic structure of molecule 2-methylene-3,3-dimethylbicyclo[2,2,1]heptane by method AB INITIO., pp. 211-214
(V.A. Babkin, D.S. Andreev)
47. Geometrical and electronic structure of molecule 2-methylbicyclo[2,2,1]geptan by method AB INITIO, pp. 215-218
(V.A. Babkin, D.S. Andreev)
Part XVIII. Compound with small cycles, pp. 219
48. Geometrical and electronic structure of molecule ethylcyclopropane by method AB INITIO, pp. 221-224
(V.A. Babkin, D.S. Andreev, E.S. Titova)
49. Geometrical and electronic structure of molecule cyclopropane by method AB INITIO, pp. 225-228
(V.A. Babkin, D.S. Andreev, E.S. Titova)
About The Editors, pp. 229-230
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