SEMIEMPIRICAL MO-LCAO CALCULATIONS OF SUBSTITUTED STYRENES .3. TOTAL VALENCE ELECTRON CALCULATION IN CNDO/2 APPROXIMATION

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GEY, E

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ZEITSCHRIFT FUR CHEMIE | 1971年 / 11卷 / 10期

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O6 [化学];

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0703 ;

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页码：392 / +

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[1] SEMIEMPIRICAL MO-LCAO CALCULATIONS OF SUBSTITUTED STYRENES .2. REACTIVITY OF SUBSTITUTED STYRENES IN RADICAL COPOLYMERIZATION WITH STYRENE
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[2] SEMIEMPIRICAL MO-LCAO CALCULATIONS ON SUBSTITUTED STYRENES .1. NMR SHIFTS, DIPOLE MOMENTS, IONIZATION POTENTIALS AND ELECTRON SPECTRA
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[3] MO-LCAO CALCULATIONS OF POLYMETHINES .1. ONE-ELECTRON APPROXIMATION FOR STREPTOPOLYMETHINES
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[4] MO-LCAO CALCULATIONS ON SULFUR-CONTAINING PI-ELECTRON SYSTEMS .37. CNDO-2-CALCULATIONS ON STABILIZATION OF CARBANIONS BY SIGMA-BIVALENT SULFUR
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[5] MO-LCAO CALCULATIONS OF SULFUR-CONTAINING PI-ELECTRON SYSTEMS .54. A THEORETICAL-STUDY OF THE DISULFIDE DITHIONE VALENCE ISOMERISM
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[6] MO-LCAO CALCULATIONS ON SULFUR-CONTAINING PI-ELECTRON SYSTEMS .26. PHYSICOCHEMICAL PROPETIES OF ALKYL SUBSTITUTED DITHIOLIUM SALTS
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[7] MO CALCULATIONS ON SUBSTITUTED SYDNONES .2. CNDO - DELBENE-JAFFE CALCULATION OF ELECTRONIC PROPERTIES OF 3-METHYLSYDNONE
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[J]. ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-LEIPZIG, 1974, 255 (02): : 412 - 418
[8] ALL VALENCE-ELECTRONS LCAO-MO-SCF STUDIES OF HYDROGEN-BONDING - CNDO/2 AND INDO CALCULATIONS OF INTRAMOLECULAR HYDROGEN-BONDING IN 5-SUBSTITUTED FURFURYL ALCOHOLS
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[J]. COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS, 1974, 39 (12) : 3613 - 3619
[9] QUANTUM CHEMICAL CALCULATIONS ON ELECTRONIC CALCULATOR RAZDAN 3 .3. INFLUENCE OF GAMMAIK-METHOD OF CALCULATION IN SCF-LCAO-MO-PPP-CI-CALCULATIONS
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[J]. PERIODICA POLYTECHNICA-CHEMICAL ENGINEERING, 1974, 18 (04) : 295 - 307
[10] STUDIES OF REACTION-MECHANISMS WITH ALL-VALENCE ELECTRON SEMIEMPIRICAL SCF-MO THEORIES .11. STRUCTURE OF ORTHO-METHYLTHIOBENZOYLOXY RADICAL AS REVEALED BY CIDNP SPECTRA AND CNDO-2 MO CALCULATIONS
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