AB INITIO STRUCTURES AND VIBRATIONAL ANALYSIS OF 2 PLANAR CONFIGURATIONS OF 1,3,5-HEXATRIENE

被引：37

作者：

BOCK, CW ^{[1
]}

PANCHENKO, YN ^{[1
]}

KRASNOSHCHIOKOV, SV ^{[1
]}

PUPYSHEV, VI ^{[1
]}

机构：

[1] MV LOMONOSOV STATE UNIV, DEPT CHEM, MOLEC SPECT LAB, MOSCOW 119899, USSR

来源：

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 1986年 / 33卷 / 1-2期

关键词：

D O I：

10.1016/0166-1280(86)85011-4

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：131 / 140

页数：10

共 34 条

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[3] STRUCTURE AND VIBRATIONAL ASSIGNMENT OF GAUCHE-1,3-BUTADIENE
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KRASNOSHCHIOKOV, SV
PUPYSHEV, VI
[J]. JOURNAL OF MOLECULAR STRUCTURE, 1985, 129 (1-2) : 57 - 67
[4] BOCK CW, 1984, J MOL STRUC-THEOCHEM, V109, P1
[5] CONFORMATIONS OF CONJUGATED HYDROCARBONS .1. SPECTROSCOPIC AND THERMODYNAMIC STUDY OF BUTA-1,3-DIENE AND 2-METHYLBUTA-1,3-DIENE (ISOPRENE)
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[J]. JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1976, (14): : 1666 - 1671
[6] CYVIN SJ, 1968, MOL VIBRATIONS MEAN
[7] MOLECULAR-FORCE FIELDS OF S-TRANS-1,3-BUTADIENE AND THE 2ND STABLE CONFORMER
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[J]. BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1983, 56 (02) : 392 - 399
[8] MATRIX-ISOLATION INFRARED AND ULTRAVIOLET SPECTROSCOPIC STUDIES OF LESS STABLE CONFORMERS OF 1,3,5-HEXATRIENE
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[J]. JOURNAL OF MOLECULAR STRUCTURE, 1983, 100 (JUL) : 341 - 350
[9] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .12. FURTHER EXTENSIONS OF GAUSSIAN-TYPE BASIS SETS FOR USE IN MOLECULAR-ORBITAL STUDIES OF ORGANIC-MOLECULES
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (05) : 2257 - +
[10] TRAPPING OF UNSTABLE CONFORMATIONS FROM THERMAL MOLECULAR-BEAMS IN ARGON MATRICES
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[J]. BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1978, 82 (01): : 10 - 12

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