SEMIEMPIRICAL MO-CALCULATIONS ON THE ELECTRONIC-SPECTRA OF BENZOQUINONECHLORIMIDES

被引：10
|
作者：
VENUVANALINGAM, P [1 ]
SINGH, UC [1 ]
SUBBARATNAM, NR [1 ]
机构：
[1] BHABHA ATOM RES CTR,DIV CHEM,BOMBAY 400085,INDIA
来源：
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY | 1980年 / 36卷 / 01期
关键词：
D O I：
10.1016/0584-8539(80)80064-X
中图分类号：
O433 [光谱学];
学科分类号：
0703 ; 070302 ;
摘要：
引用
收藏
页码：103 / 107
页数：5
相关论文
共 50 条
  • [1] SEMIEMPIRICAL MO-CALCULATIONS ON THE ELECTRONIC-SPECTRA OF AZIDO SUBSTITUTED PARA-BENZOQUINONES
    SINGH, UC
    RAMACHANDRAN, MS
    SUBBARATNAM, NR
    KELKAR, VK
    SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 1979, 35 (06) : 663 - 667
  • [2] APPLICATION OF SEMIEMPIRICAL MO-CALCULATIONS TO THE INTERACTION OF HYDROCARBONS WITH ZEOLITES
    FORSTER, H
    GRODZICKI, M
    ZAKHARIEVAPENCHEVA, O
    JOURNAL OF MOLECULAR STRUCTURE, 1986, 143 : 267 - 270
  • [3] ELECTRONIC-SPECTRA AND SEMIEMPIRICAL CALCULATIONS ON DINEGATIVE IONS OF ACENAPHTHYLENE, FLUORANTHENE AND ACEHEPTYLENE
    REJHOLEC, V
    PANCIR, J
    ZAHRADNI.R
    CARSKY, P
    COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS, 1972, 37 (06) : 1978 - &
  • [4] SEMIEMPIRICAL CALCULATIONS OF ELECTRONIC-SPECTRA - UTILITY IN THE DESIGN OF MID UV SENSITIZERS
    MILLER, RD
    WILLSON, CG
    MCKEAN, DR
    TOMPKINS, T
    CLECAK, N
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1983, 185 (MAR): : 13 - ORPL
  • [5] SEMIEMPIRICAL CALCULATIONS OF ELECTRONIC-SPECTRA - USE IN THE DESIGN OF MID-UV SENSITIZERS
    MILLER, RD
    MCKEAN, DR
    TOMPKINS, TL
    CLECAK, N
    WILLSON, CG
    MICHL, J
    DOWNING, J
    ACS SYMPOSIUM SERIES, 1984, 242 : 25 - 40
  • [6] Conformational analysis of tetracycline using molecular mechanical and semiempirical MO-calculations
    Lanig, H
    Gottschalk, M
    Schneider, S
    Clark, T
    JOURNAL OF MOLECULAR MODELING, 1999, 5 (03) : 46 - 62
  • [7] SEMIEMPIRICAL ALL-VALENCE-ELECTRON MO CALCULATIONS ON ELECTRONIC-SPECTRA OF LINEAR RADICALS WITH DEGENERATE GROUND-STATES
    CARSKY, P
    KUHN, J
    ZAHRADNIK, R
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1975, 55 (1-3) : 120 - 130
  • [8] Conformational Analysis of Tetracycline using Molecular Mechanical and Semiempirical MO-Calculations
    Harald Lanig
    Maik Gottschalk
    Siegfried Schneider
    Timothy Clark
    Molecular modeling annual, 1999, 5 : 46 - 62
  • [9] SEMIEMPIRICAL STUDY ON THE ELECTRONIC-SPECTRA OF MODEL CYANOMETMB
    DU, P
    LOEW, GH
    JOURNAL OF PHYSICAL CHEMISTRY, 1991, 95 (16): : 6379 - 6383
  • [10] SIMPLE SEMI-EMPIRICAL MO-CALCULATIONS OF ELECTRONIC-SPECTRA AND CHARGE-DISTRIBUTION IN 2,4,6-TRIMETHYL PYRYLIUM CATION
    VLAHOVICI, N
    FRANGOPOL, PT
    REVUE ROUMAINE DE CHIMIE, 1977, 22 (9-10) : 1379 - 1384
12345