CALCULATIONS OF GEOMETRIES OF ORGANIC MOLECULES USING CNDO/2 MOLECULAR ORBITAL METHOD .2. STRUCTURAL PREDICTIONS FOR BENZOCYCLOALKENES, AND A THEORETICAL RATIONALIZATION OF THEIR PROTON-PROTON SPIN-SPIN COUPLING CONSTANTS

被引：46

作者：

CHEUNG, CS

COOPER, MA

MANATT, SL

机构：

来源：

TETRAHEDRON | 1971年 / 27卷 / 04期

关键词：

D O I：

10.1016/S0040-4020(01)92466-4

中图分类号：

O62 [有机化学];

学科分类号：

070303 ; 081704 ;

摘要：

引用

页码：701 / &

共 23 条

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[3] SYNTHESIS AND STUDY OF PSEUDOAROMATIC COMPOUNDS .X. A REEVALUATION OF QUESTION OF AROMATIC CHARACTER IN TROPONE, TROPOLONE, AND SUBSTITUTED HEPTAFULVENES BASED ON ANALYSIS OF NUCLEAR MAGNETIC RESONANCE SPECTRA OF THESE AND SEVERAL RELATED COMPOUNDS [J].

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[4] CALCULATIONS OF GEOMETRIES OF ORGANIC MOLECULES USING CNDO/2 METHOD .1. EMPIRICAL CORRELATIONS BETWEEN OBSERVED AND CALCULATED BOND LENGTHS IN SIMPLE ACYCLICS, STRAINED CYCLOALKENES AND SOME POLYCYCLIC MOLECULES [J].

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[5]

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[6] EFFECT OF STERIC COMPRESSION ON PROTON-PROTON, SPIN-SPIN COUPLING CONSTANTS - FURTHER EVIDENCE AND MECHANISTIC CONSIDERATIONS [J].

COOPER, MA ;

MANATT, SL .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (15) :4646-+

[7] PROTON NMR SPECTRA OF CYCLOPENTADIENE, 1,3-CYCLOHEXADIENE, 1,3-CYCLOOCTADIENE, AND 1,2-DIHYDRONAPHTHALENE [J].

COOPER, MA ;

ELLEMAN, DD ;

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MANATT, SL .

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[8] ANALYSIS OF PROTON NUCLEAR MAGNETIC RESONANCE SPECTRA OF SOME STRAINED BENZOCYCLOALKENES AND BENZOCYCLOALKENEDIONES . EFFECT OF STRAIN ON PROTON-PROTON, SPIN-SPIN COUPLING CONSTANTS [J].

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JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (06) :1605-&

[9] A CRITICAL EVALUATION OF DEPENDENCE OF 3JHH COUPLINGS ON BOND ORDER AND BOND LENGTH IN CONJUGATED CARBOCYCLIC MOLECULES . EVIDENCE FOR A STERIC EFFECT ON 3JHH [J].

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