ACCURATE THEORETICAL ESTIMATES OF THE ELECTRON-AFFINITIES OF AHN MOLECULES BY ISOGYRIC COMPARISONS - PROTON AFFINITIES OF AH-N ANIONS

被引：64

作者：

POPLE, JA ^{[1
]}

SCHLEYER, PV ^{[1
]}

KANETI, J ^{[1
]}

SPITZNAGEL, GW ^{[1
]}

机构：

[1] UNIV ERLANGEN NURNBERG,INST ORGAN CHEM,D-8520 ERLANGEN,FED REP GER

来源：

CHEMICAL PHYSICS LETTERS | 1988年 / 145卷 / 05期

关键词：

D O I：

10.1016/0009-2614(88)80190-8

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：359 / 364

页数：6

共 42 条

[1] ACCURATE NUMERICAL ORBITAL MBPT/CC STUDY OF THE ELECTRON-AFFINITY OF FLUORINE AND THE DISSOCIATION-ENERGY OF HYDROGEN-FLUORIDE [J].

ADAMOWICZ, L ;

BARTLETT, RJ .

JOURNAL OF CHEMICAL PHYSICS, 1986, 84 (12) :6837-6839

[2] THE EVALUATION OF MOLECULAR ELECTRON-AFFINITIES [J].

BAKER, J ;

NOBES, RH ;

RADOM, L .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1986, 7 (03) :349-358

[3]

BARRETT RN, 1986, J CHEM PHYS, V84, P4992

[4] SCALE OF ACIDITIES IN THE GAS-PHASE FROM METHANOL TO PHENOL [J].

BARTMESS, JE ;

SCOTT, JA ;

MCIVER, RT .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1979, 101 (20) :6046-6056

[5]

BARTMESS JE, 1979, GAS PHASE ION CHEM, V2, pCH10

[6] ON THE ELECTRON-AFFINITY OF THE OXYGEN ATOM [J].

BAUSCHLICHER, CW ;

LANGHOFF, SR ;

PARTRIDGE, H ;

TAYLOR, PR .

JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (06) :3407-3410

[7] A FULL CL TREATMENT OF THE 1A1-3B1 SEPARATION IN METHYLENE [J].

BAUSCHLICHER, CW ;

TAYLOR, PR .

JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (11) :6510-6512

[8] THEORETICAL CHARACTERIZATION OF NEGATIVE-IONS - CALCULATION OF THE ELECTRON-AFFINITIES OF CARBON, OXYGEN, AND FLUORINE [J].

BOTCH, BH ;

DUNNING, TH .

JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (12) :6046-6056

[9] EFFICIENT AND ACCURATE CALCULATION OF ANION PROTON AFFINITIES [J].

CHANDRASEKHAR, J ;

ANDRADE, JG ;

SCHLEYER, PV .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (18) :5609-5612

[10]

Chase Jr M. W., 1985, J PHYS CHEM REF D S1, V14

← 1 2 3 4 5 →