THEORETICAL DETERMINATION OF MOLECULAR-STRUCTURE AND CONFORMATION .10. GEOMETRY AND PUCKERING POTENTIAL OF AZETIDINE, (CH2)3NH, COMBINATION OF ELECTRON-DIFFRACTION AND ABINITIO STUDIES

被引：66

作者：

CREMER, D ^{[1
]}

DOROFEEVA, OV ^{[1
]}

MASTRYUKOV, VS ^{[1
]}

机构：

[1] MV LOMONOSOV STATE UNIV,DEPT CHEM,ELECTRON DIFFRACT LAB,MOSCOW 117234,USSR

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1981年 / 75卷 / 02期

关键词：

D O I：

10.1016/0022-2860(81)85237-4

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：225 / 240

页数：16

共 54 条

[21] HAMILTON WC, 1964, STATISTICS PHYSICAL
[22] INFLUENCE OF POLARIZATION FUNCTIONS ON MOLECULAR-ORBITAL HYDROGENATION ENERGIES
HARIHARA.PC
POPLE, JA
[J]. THEORETICA CHIMICA ACTA, 1973, 28 (03): : 213 - 222
[23] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .I. USE OF GAUSSIAN EXPANSIONS OF SLATER-TYPE ATOMIC ORBITALS
HEHRE, WJ
STEWART, RF
POPLE, JA
[J]. JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (06) : 2657 - +
[24] QUALITY OF GAUSSIAN BASIS SETS - DIRECT OPTIMIZATION OF ORBITAL EXPONENTS BY METHOD OF CONJUGATE GRADIENTS
KARI, RE
MEZEY, PG
CSIZMADIA, IG
[J]. JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (01) : 581 - 585
[25] EFFECT OF ANHARMONIC VIBRATIONS ON BOND LENGTHS OF POLYATOMIC MOLECULES .3. EQUILIBRIUM P-H DISTANCE OF PHOSPHINE
KUCHITSU, K
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1961, 7 (06) : 399 - &
[26] AVERAGE VALUES OF BOND ANGLES
KUCHITSU, K
[J]. BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1971, 44 (01) : 96 - +
[27] ESTIMATION OF ANHARMONIC POTENTIAL CONSTANTS .2. BENT XY2 MOLECULES
KUCHITSU, K
MORINO, Y
[J]. BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1965, 38 (05) : 814 - +
[28] EFFECT OF ANHARMONIC VIBRATIONS ON BOND LENGTHS OF POLYATOMIC MOLECULES .2. CUBIC CONSTANTS AND EQUILIBRIUM BOND LENGTHS OF METHANE
KUCHITSU, K
BARTELL, LS
[J]. JOURNAL OF CHEMICAL PHYSICS, 1962, 36 (09) : 2470 - &
[29] EFFECTS OF ANHARMONICITY OF MOLECULAR VIBRATIONS ON DIFFRACTION OF ELECTRONS .2. INTERPRETATION OF EXPERIMENTAL STRUCTURAL PARAMETERS
KUCHITSU, K
BARTELL, LS
[J]. JOURNAL OF CHEMICAL PHYSICS, 1961, 35 (06) : 1945 - &
[30] ESTIMATION OF ANHARMONIC POTENTIAL CONSTANTS .I. LINEAR XY2 MOLECULES
KUCHITSU, K
MORINO, Y
[J]. BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1965, 38 (05) : 805 - +

← 1 2 3 4 5 6 →