Molecular Mechanics Calculation of Inner-Shell Activation Barriers to Heterogeneous Electron Transfer in M(tacn)23+/2+ Redox Couples (M = Fe, Co, Ni; tacn = 1,4,7-Triazacyclononane)

Ying-Duo Gao; Kenny B. Lipkowitz; Franklin A. Schultz

doi:10.1021/ja00153a015

Molecular Mechanics Calculation of Inner-Shell Activation Barriers to Heterogeneous Electron Transfer in M(tacn)23+/2+ Redox Couples (M = Fe, Co, Ni; tacn = 1,4,7-Triazacyclononane)

Journal of the American Chemical Society ◽

10.1021/ja00153a015 ◽

1995 ◽

Vol 117 (48) ◽

pp. 11932-11938 ◽

Cited By ~ 12

Author(s):

Ying-Duo Gao ◽

Kenny B. Lipkowitz ◽

Franklin A. Schultz

Keyword(s):

Electron Transfer ◽

Molecular Mechanics ◽

Activation Barriers ◽

Heterogeneous Electron Transfer ◽

Redox Couples ◽

Molecular Mechanics Calculation

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Solvent effects of heterogeneous electron transfer rates for organic redox couples: tert-nitrobutane reduction at mercury

Journal of Electroanalytical Chemistry ◽

10.1016/0022-0728(87)85013-1 ◽

1987 ◽

Vol 233 (1-2) ◽

pp. 161-172 ◽

Cited By ~ 23

Author(s):

Dennis A. Corrigan ◽

Dennis H. Evans

Keyword(s):

Electron Transfer ◽

Solvent Effects ◽

Transfer Rates ◽

Heterogeneous Electron Transfer ◽

Redox Couples

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Determination of the heterogeneous electron-transfer rate constants for the redox couples Mo(CN)4−3−8, W(CN)4−3−8, Fe(CN)4−3−6, Os(CN)4−3−6 and IrCl3−2−6 using fast sweep cyclic voltammetry at carbon fibre electrodes

Journal of Electroanalytical Chemistry ◽

10.1016/0022-0728(89)80198-6 ◽

1989 ◽

Vol 265 (1-2) ◽

pp. 297-304 ◽

Cited By ~ 23

Author(s):

Noboru Oyama ◽

Takeo Ohsaka ◽

Nobushige Yamamoto ◽

Junichiro Matsui ◽

Osamu Hatozaki

Keyword(s):

Electron Transfer ◽

Cyclic Voltammetry ◽

Carbon Fibre ◽

Rate Constants ◽

Transfer Rate ◽

Electron Transfer Rate ◽

Heterogeneous Electron Transfer ◽

Redox Couples

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Inner-Shell Effects on Heterogeneous Electron-Transfer Rates of Bis(1,4,7-Triazacyclononane) (tacn) Redox Couples, M(tacn)23+/2+ (M = Fe, Co, Ni, Ru)

Inorganic Chemistry ◽

10.1021/ic00097a023 ◽

1994 ◽

Vol 33 (19) ◽

pp. 4344-4350 ◽

Cited By ~ 15

Author(s):

Philip W. Crawford ◽

Franklin A. Schultz

Keyword(s):

Electron Transfer ◽

Transfer Rates ◽

Shell Effects ◽

Heterogeneous Electron Transfer ◽

Redox Couples

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Surprising Odd-Even Oscillation in the Heterogeneous Electron Transfer Rate of Solution-Based Redox Couples at Short-Chain Alkanethiolate Monolayers on Gold

ECS Meeting Abstracts ◽

10.1149/ma2005-02/35/1254 ◽

2005 ◽

Keyword(s):

Electron Transfer ◽

Transfer Rate ◽

Short Chain ◽

Electron Transfer Rate ◽

Heterogeneous Electron Transfer ◽

Redox Couples

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A force field for molecular mechanics modeling of cobalt(II) amine complexes and a new model of electron transfer for cobalt(III)-cobalt(II) redox couples

Inorganic Chemistry ◽

10.1021/ic00206a045 ◽

1985 ◽

Vol 24 (12) ◽

pp. 1920-1928 ◽

Cited By ~ 35

Author(s):

A. M. Bond ◽

T. W. Hambley ◽

M. R. Snow

Keyword(s):

Electron Transfer ◽

Force Field ◽

Molecular Mechanics ◽

New Model ◽

Amine Complexes ◽

Redox Couples

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Odd-Even Oscillation in the Rate of Heterogeneous Electron Transfer for Solution-Based Redox Couples at Short-Chain Alkanethiolate Monolayers on Gold

ECS Meeting Abstracts ◽

10.1149/ma2008-01/36/1138 ◽

2008 ◽

Keyword(s):

Electron Transfer ◽

Short Chain ◽

Heterogeneous Electron Transfer ◽

Redox Couples

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ChemInform Abstract: A FORCE FIELD FOR MOLECULAR MECHANICS MODELING OF COBALT(II) AMINE COMPLEXES AND A NEW MODEL OF ELECTRON TRANSFER FOR COBALT(III)-COBALT(II) REDOX COUPLES

Chemischer Informationsdienst ◽

10.1002/chin.198541288 ◽

1985 ◽

Vol 16 (41) ◽

Author(s):

A. M. BOND ◽

T. W. HAMBLEY ◽

M. R. SNOW

Keyword(s):

Electron Transfer ◽

Force Field ◽

Molecular Mechanics ◽

New Model ◽

Amine Complexes ◽

Redox Couples

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The Analysis of Solvent Effects on the Kinetics of Simple Heterogeneous Electron Transfer Reactions

10.21236/ada210078 ◽

1988 ◽

Author(s):

W. R. Fawcett ◽

Jr Foss ◽

C. A.

Keyword(s):

Electron Transfer ◽

Solvent Effects ◽

Transfer Reactions ◽

Electron Transfer Reactions ◽

Heterogeneous Electron Transfer ◽

Kinetics Of

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Variation of the heterogeneous electron-transfer rate constant with solution viscosity: reduction of aqueous solutions of [(EDTA)chromium(III)]- at a mercury electrode

Journal of the American Chemical Society ◽

10.1021/ja00241a005 ◽

1987 ◽

Vol 109 (7) ◽

pp. 1916-1920 ◽

Cited By ~ 53

Author(s):

Xun Zhang ◽

Hongjun Yang ◽

Allen J. Bard

Keyword(s):

Electron Transfer ◽

Aqueous Solutions ◽

Rate Constant ◽

Transfer Rate ◽

Mercury Electrode ◽

Viscosity Reduction ◽

Solution Viscosity ◽

Electron Transfer Rate ◽

Heterogeneous Electron Transfer ◽

Electron Transfer Rate Constant

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A hydration function scheme of electron transfer kinetics for hydrated redox couples in solution and its application in the system

Journal of Molecular Structure THEOCHEM ◽

10.1016/s0166-1280(97)00005-5 ◽

1997 ◽

Vol 401 (1-2) ◽

pp. 35-43

Author(s):

Yuxiang Bu ◽

Faxin He ◽

Yangjun Ding ◽

Conghao Deng

Keyword(s):

Electron Transfer ◽

Electron Transfer Kinetics ◽

Redox Couples

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