CALCULATION OF DIPOLE-MOMENTS USING GENERALIZED HUCKEL METHOD

被引：0

作者：

BOTREL, A ^{[1
]}

机构：

[1] UNIV RENNES,LAB CHIM THEORIQUE,RENNES 35031,FRANCE

来源：

COMPTES RENDUS HEBDOMADAIRES DES SEANCES DE L ACADEMIE DES SCIENCES SERIE C | 1973年 / 276卷 / 04期

关键词：

D O I：

暂无

中图分类号：

Q5 [生物化学]; Q7 [分子生物学];

学科分类号：

071010 ; 081704 ;

摘要：

引用

页码：339 / 341

页数：3

共 9 条

[1]

BOTREL A, TO BE PUBLISHED

[2] DIRECT COMPARISON OF EH AND CNDO CHARGE DISTRIBUTIONS FOR ADENINE [J].

BOYD, DB .

THEORETICA CHIMICA ACTA, 1972, 23 (04) :383-&

[3] MICROWAVE SPECTRUM QUADRUPOLE COUPLING CONSTANTS AND DIPOLE MOMENT OF NITROETHYLENE [J].

HESS, HD ;

BAUDER, A ;

GUNTHARD, HH .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1967, 22 (02) :208-&

[4] AN EXTENDED HUCKEL THEORY .I. HYDROCARBONS [J].

HOFFMANN, R .

JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (06) :1397-&

[5] ELECTRONIC STRUCTURE OF METHYLENES [J].

HOFFMANN, R ;

ZEISS, GD ;

VANDINE, GW .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1968, 90 (06) :1485-&

[6] THE RELATION BETWEEN CONFIGURATION AND CONJUGATION IN DIPHENYL DERIVATIVES .4. THE DIPOLE MOMENTS OF THE 2-2'-DIHALOGENO-DIPHENYLS AND 2-2'-DINITRO-DIPHENYLS AND 3-3'-DINITRO-DIPHENYLS [J].

LITTLEJOHN, AC ;

SMITH, JW .

JOURNAL OF THE CHEMICAL SOCIETY, 1954, (JUL) :2552-2556

[7] ELECTRONIC STRUCTURE OF PURINES AND PYRIMIDINES [J].

PULLMAN, A .

ANNALS OF THE NEW YORK ACADEMY OF SCIENCES, 1969, 158 (A1) :65-&

[8] ENERGY PARAMETERS IN POLYPEPTIDES .2. SEMIEMPIRICAL MOLECULAR ORBITAL CALCULATIONS FOR MODEL PEPTIDES [J].

YAN, JF ;

MOMANY, FA ;

HOFFMANN, R ;

SCHERAGA, HA .

JOURNAL OF PHYSICAL CHEMISTRY, 1970, 74 (02) :420-&

[9]

1965, INTERATOMIC DISTAN S

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