CORRELATION OF FREE-ELECTRON MOLECULAR-ORBITAL ENERGIES WITH PI-IONIZATION ENERGIES OF AROMATIC-HYDROCARBONS

被引：8

作者：

VONSZENTPALY, L ^{[1
]}

机构：

[1] UNIV MARBURG, FACHBEREICH PHYS CHEM, D-3550 MARBURG, FED REP GER

来源：

CHEMICAL PHYSICS LETTERS | 1979年 / 67卷 / 01期

关键词：

D O I：

10.1016/0009-2614(79)87106-7

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：63 / 68

页数：6

共 50 条

[21] FREE-ELECTRON MOLECULAR-ORBITAL TREATMENT OF CHALCONE GROUP OF DYES
BASU, B
TIWARI, RD
DEY, AK
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1979, 16 (06) : 1337 - 1346
[22] CONFIGURATION INTERACTION IN GENERALIZED FREE-ELECTRON MOLECULAR-ORBITAL METHOD .3. IONIZATION POTENTIALS AND ELECTRON AFFINITIES
ZURAWSKI, B
LESNIAK, A
BULLETIN DE L ACADEMIE POLONAISE DES SCIENCES-SERIE DES SCIENCES CHIMIQUES, 1973, 21 (03): : 171 - 174
[23] STRUCTURE ACTIVITY RELATIONSHIP OF MUTAGENIC AROMATIC AND HETEROAROMATIC NITRO-COMPOUNDS - CORRELATION WITH MOLECULAR-ORBITAL ENERGIES AND HYDROPHOBICITY
DEBNATH, AK
DECOMPADRE, RLL
DEBNATH, G
SHUSTERMAN, AJ
HANSCH, C
JOURNAL OF MEDICINAL CHEMISTRY, 1991, 34 (02) : 786 - 797
[24] ELECTRON AFFINITIES, METHYL AFFINITIES, AND IONIZATION ENERGIES OF CONDENSED RING AROMATIC HYDROCARBONS
MATSEN, FA
JOURNAL OF CHEMICAL PHYSICS, 1956, 24 (03): : 602 - 608
[25] Rapid quantitative prediction of ionization energies and electron affinities of polycyclic aromatic hydrocarbons
Modelli, Alberto
Mussoni, Laura
CHEMICAL PHYSICS, 2007, 332 (2-3) : 367 - 374
[26] Characterization of aromatic hydrocarbons by means of average local ionization energies on their molecular surfaces
Murray, JS
Abu-Awwad, F
Politzer, P
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2000, 501 : 241 - 250
[27] ESTIMATION OF BINDING-ENERGIES OF MOLECULES BY A SEMIEMPIRICAL MOLECULAR-ORBITAL ELECTRON CORRELATION METHOD WITH APPLICATIONS TO SATURATED AND UNSATURATED-HYDROCARBONS, AROMATICS, AND HETEROCYCLICS
SINANOGLU, O
PAMUK, HO
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (17) : 5435 - 5442
[28] MOLECULAR-ORBITAL STUDY OF BIMETALLIC COMPLEXES CONTAINING CONJUGATED AND AROMATIC-HYDROCARBONS AS BRIDGING LIGANDS
ZHU, LG
KOSTIC, NM
ORGANOMETALLICS, 1988, 7 (03) : 665 - 669
[29] A MOLECULAR-ORBITAL STUDY OF BONDING AND IONIZATION ENERGIES IN PENTAVALENT URANIUM IMIDE AMIDE COMPLEXES
BOWMAKER, GA
GORLING, A
HABERLEN, O
ROSCH, N
GOODMAN, GL
ELLIS, DE
INORGANIC CHEMISTRY, 1992, 31 (04) : 577 - 581
[30] ENTHALPIES AND GIBBS FREE-ENERGIES OF HYDRATION OF AROMATIC-HYDROCARBONS AND THEIR HALOGEN-DERIVATIVES
BORISOVER, MD
BAITALOV, FD
SOLOMONOV, BN
ZHURNAL OBSHCHEI KHIMII, 1991, 61 (12): : 2629 - 2638

← 1 2 3 4 5 →