ABINITIO MOLECULAR-ORBITAL STUDY OF THE STRUCTURES AND ENERGIES OF NEUTRAL AND CHARGED BIMOLECULAR COMPLEXES OF H2O WITH THE HYDRIDES NH-ETA, OH-ETA, FH-ETA, PH-ETA, SH-ETA AND CLH-ETA

被引：179

作者：

DELBENE, JE

机构：

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1988年 / 92卷 / 10期

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D O I：

10.1021/j100321a035

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：

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页码：2874 / 2880

页数：7

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共 88 条

[1] POSSIBLE CATALYTIC EFFECT OF WATER ON SOME NUCLEOPHILIC-SUBSTITUTION REACTIONS IN INERT SOLVENTS
ALAGONA, G
SCROCCO, E
TOMASI, J
[J]. THEORETICA CHIMICA ACTA, 1978, 47 (02): : 133 - 145
[2] SIMPLE MODEL OF HYDROGEN-BONDING
ALLEN, LC
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (24) : 6921 - 6940
[3] HYDROGEN-BONDED COMPLEXES INVOLVING HF AND HCL - THE EFFECTS OF ELECTRON CORRELATION AND ANHARMONICITY
AMOS, RD
GAW, JF
HANDY, NC
SIMANDIRAS, ED
SOMASUNDRAM, K
[J]. THEORETICA CHIMICA ACTA, 1987, 71 (01): : 41 - 57
[4] STRUCTURES, HARMONIC FREQUENCIES AND INFRARED INTENSITIES OF THE DIMERS OF H2O AND H2S
AMOS, RD
[J]. CHEMICAL PHYSICS, 1986, 104 (01) : 145 - 151
[5] HYDRATION OF HALIDE NEGATIVE IONS IN GAS PHASE .2. COMPARISON OF HYDRATION ENERGIES FOR ALKALI POSITIVE AND HALIDE NEGATIVE IONS
ARSHADI, M
YAMDAGNI, R
KEBARLE, P
[J]. JOURNAL OF PHYSICAL CHEMISTRY, 1970, 74 (07) : 1475 - &
[6] BERTHOD H, 1980, ISRAEL J CHEM, V19, P299
[7] IS THE CARBOXYLIC ACID FLUORIDE BOND REALLY THE STRONGEST TYPE OF HYDROGEN-BOND
BOUMA, WJ
RADOM, L
[J]. CHEMICAL PHYSICS LETTERS, 1979, 64 (02) : 216 - 218
[8] CHIN S, 1985, THEOCHEM, V26, P193
[9] EFFICIENT DIFFUSE FUNCTION-AUGMENTED BASIS SETS FOR ANION CALCULATIONS. III. THE 3-21+G BASIS SET FOR FIRST-ROW ELEMENTS, LI-F
CLARK, T
CHANDRASEKHAR, J
SPITZNAGEL, GW
SCHLEYER, PV
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1983, 4 (03) : 294 - 301
[10] STUDIES OF MOLECULAR ASSOCIATION IN H2O AND D2O VAPORS BY MEASUREMENT OF THERMAL-CONDUCTIVITY
CURTISS, LA
FRURIP, DJ
BLANDER, M
[J]. JOURNAL OF CHEMICAL PHYSICS, 1979, 71 (06) : 2703 - 2711

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