Stereoelectronic effects in the hydrolysis of cyclic five-membered-ring phosphate esters. Ab initio and CNDO molecular orbital calculations on alkyloxyphosphoranes

David G. Gorenstein; Bruce A. Luxon; John B. Findlay; Robert Momii

doi:10.1021/ja00454a053

Stereoelectronic effects in the hydrolysis of cyclic five-membered-ring phosphate esters. Ab initio and CNDO molecular orbital calculations on alkyloxyphosphoranes

Journal of the American Chemical Society ◽

10.1021/ja00454a053 ◽

1977 ◽

Vol 99 (12) ◽

pp. 4170-4172 ◽

Cited By ~ 35

Author(s):

David G. Gorenstein ◽

Bruce A. Luxon ◽

John B. Findlay ◽

Robert Momii

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Membered Ring ◽

Phosphate Esters ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects ◽

Hydrolysis Of

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ChemInform Abstract: STEREOELECTRONIC EFFECTS IN THE HYDROLYSIS OF CYCLIC FIVE-MEMBERED-RING PHOSPHATE ESTERS. AB INITIO AND CNDO MOLECULAR ORBITAL CALCULATIONS ON ALKYLOXYPHOSPHORANES

Chemischer Informationsdienst ◽

10.1002/chin.197736088 ◽

1977 ◽

Vol 8 (36) ◽

pp. no-no

Author(s):

D. G. GORENSTEIN ◽

B. A. LUXON ◽

J. B. FINDLAY ◽

R. MOMII

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Membered Ring ◽

Phosphate Esters ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects ◽

Hydrolysis Of

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Rate limiting P-O(5') bond cleavage of RNA fragment: ab initio molecular orbital calculations on the base-catalyzed hydrolysis of phosphate

Nucleic Acids Research ◽

10.1093/nar/19.10.2747 ◽

1991 ◽

Vol 19 (10) ◽

pp. 2747-2753 ◽

Cited By ~ 16

Author(s):

K. Taira ◽

T. Uchimaru ◽

K. Tanabe ◽

M. Uebayasi ◽

S. Nishikawa

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Bond Cleavage ◽

Molecular Orbital Calculations ◽

Rate Limiting ◽

Hydrolysis Of

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Stereoelectronic Effects in Serine Proteases: Ab Initio Molecular Orbital Calculations

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.60.3625 ◽

1987 ◽

Vol 60 (10) ◽

pp. 3625-3632 ◽

Cited By ~ 8

Author(s):

Kazunari Taira ◽

David G. Gorenstein

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Serine Proteases ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects

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ChemInform Abstract: STEREOELECTRONIC EFFECTS IN THE REACTIONS OF PHOSPHATE DIESTERS. AB INITIO MOLECULAR ORBITAL CALCULATIONS OF REACTION SURFACES. 2

Chemischer Informationsdienst ◽

10.1002/chin.198003123 ◽

1980 ◽

Vol 11 (3) ◽

Author(s):

D. G. GORENSTEIN ◽

B. A. LUXON ◽

J. B. FINDLAY

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects ◽

Phosphate Diesters ◽

Reaction Surfaces

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ChemInform Abstract: STEREOELECTRONIC EFFECTS IN THE REACTIONS OF PHOSPHATE DIESTERS. AB INITIO MOLECULAR ORBITAL CALCULATIONS OF REACTION PROFILES

Chemischer Informationsdienst ◽

10.1002/chin.197810154 ◽

1978 ◽

Vol 9 (10) ◽

Author(s):

D. G. GORENSTEIN ◽

B. A. LUXON ◽

J. B. FINDLAY

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects ◽

Phosphate Diesters

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ChemInform Abstract: STEREOELECTRONIC EFFECTS IN THE REACTIONS OF PHOSPHATE DIESTERS, PHOSPHORAMIDATES, AND PHOSPHONATES. 3. AB INITIO MOLECULAR ORBITAL CALCULATIONS OF TRANSITION STATES

Chemischer Informationsdienst ◽

10.1002/chin.198023075 ◽

1980 ◽

Vol 11 (23) ◽

Author(s):

D. G. GORENSTEIN ◽

B. A. LUXON ◽

E. M. GOLDFIELD

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Transition States ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects ◽

Phosphate Diesters

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ChemInform Abstract: STEREOELECTRONIC EFFECTS ON THE BASICITY AND NUCLEOPHILICITY OF PHOSPHITES AND PHOSPHATES. AB INITIO MOLECULAR ORBITAL CALCULATIONS AND THE α-EFFECT

Chemischer Informationsdienst ◽

10.1002/chin.198515074 ◽

1985 ◽

Vol 16 (15) ◽

Author(s):

K. TAIRA ◽

D. G. GORENSTEIN

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects

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Stereoelectronic effects on the basicity and nucleophilicity of phosphites and phosphates. Ab initio molecular orbital calculations and the .alpha.-effect

Journal of the American Chemical Society ◽

10.1021/ja00337a028 ◽

1984 ◽

Vol 106 (25) ◽

pp. 7825-7831 ◽

Cited By ~ 22

Author(s):

Kazunari Taira ◽

David G. Gorenstein

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects ◽

Alpha Effect

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Stereoelectronic effects in the reactions of phosphate diesters. Ab initio molecular orbital calculations of reaction surfaces. 2

Journal of the American Chemical Society ◽

10.1021/ja00514a001 ◽

1979 ◽

Vol 101 (20) ◽

pp. 5869-5875 ◽

Cited By ~ 37

Author(s):

David G. Gorenstein ◽

Bruce A. Luxon ◽

John B. Findlay

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Molecular Orbital Calculations ◽

Stereoelectronic Effects ◽

Phosphate Diesters ◽

Reaction Surfaces

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Gas-phase hydrolysis of protonated oxirane. Ab initio and semiempirical molecular orbital calculations

Journal of the American Chemical Society ◽

10.1021/ja00239a007 ◽

1987 ◽

Vol 109 (5) ◽

pp. 1325-1331 ◽

Cited By ~ 30

Author(s):

George P. Ford ◽

Christopher T. Smith

Keyword(s):

Ab Initio ◽

Gas Phase ◽

Molecular Orbital ◽

Molecular Orbital Calculations ◽

Hydrolysis Of ◽

Semiempirical Molecular Orbital

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