SEMI-EMPIRICAL CALCULATION INCLUDING ALL VALENCE ELECTRONS - EFFECT OF FLUORINE SUBSTITUTION IN BENZENES AND PYRIDINES

被引：14

作者：

EMSLEY, JW

机构：

来源：

JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL | 1968年 / 11期

关键词：

D O I：

10.1039/j19680002735

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

收藏

页码：2735 / +

页数：1

相关论文

共 27 条

[1] MOLECULAR PHOTOELECTRON SPECTROSCOPY .7. VERTICAL IONISATION POTENTIALS OF BENZENE AND SOME OF ITS MONOSUBSTITUTED AND 1,4-DISUBSTITUTED DERIVATIVES
BAKER, AD
MAY, DP
TURNER, DW
[J]. JOURNAL OF THE CHEMICAL SOCIETY B-PHYSICAL ORGANIC, 1968, (01): : 22 - &
[2] EFFECTS OF PI-ELECTRON DISTRIBUTION + INTRAMOLECULAR ELECTRIC FIELDS ON 19F NMR SHIELDING IN SUBSTITUTED PERFLUOROBENZENES
BODEN, N
FEENEY, J
SUTCLIFFE, LH
EMSLEY, JW
[J]. MOLECULAR PHYSICS, 1964, 8 (02) : 133 - &
[3] CHEMICAL SHIFT ANISOTROPIES FROM NUCLEAR MAGNETIC RESONANCE STUDIES OF ORIENTED MOLECULES
BUCKINGHAM, AD
BURNELL, EE
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1967, 89 (13) : 3341 - +
[4] ATOMIC SHIELDING PARAMETERS
BURNS, G
[J]. JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (05) : 1521 - &
[5] FLUORINE CHEMICAL SHIFTS IN AROMATIC SYSTEMS
CALDOW, GL
[J]. MOLECULAR PHYSICS, 1966, 11 (01) : 71 - &
[6] FLUORINE SPIN-ROTATION INTERACTION AND MAGNETIC SHIELDING IN FLUOROBENZENE
CHAN, SI
DUBIN, AS
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (05) : 1745 - &
[7] A SELF CONSISTENT FIELD MOLECULAR ORBITAL INVESTIGATION OF IMPORTANCE OF D ORBITAL PARTICIPATION IN GROUND STATE OF THIOPHENE
CLARK, DT
[J]. TETRAHEDRON, 1968, 24 (06) : 2663 - &
[8] A STUDY OF ENERGY LEVELS IN BENZENE AND SOME FLUOROBENZENES BY PHOTOELECTRON SPECTROSCOPY
CLARK, ID
FROST, DC
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1967, 89 (02) : 244 - &
[9] ALL VALENCY ELECTRON MOLECULAR ORBITAL CALCULATIONS .1. DIPOLE MOMENTS SPIN DENSITIES AND 19F SHIELDING CONSTANTS IN SOME FLUOROBENZENES AND FLUORONITROBENZENES
DAVIES, DW
[J]. MOLECULAR PHYSICS, 1967, 13 (05) : 465 - &
[10] DEWAR MJS, 1967, TETRAHEDRON LETT, P2341