Structural and Energetic Preferences of π, σ, and Bidentate Cation Binding (Li+, Na+, and Mg2+) to Aromatic Amines (Ph−(CH2)n−NH2,n= 2−5): A Theoretical Study

J. Srinivasa Rao; G. Narahari Sastry

doi:10.1021/jp811124g

Structural and Energetic Preferences of π, σ, and Bidentate Cation Binding (Li+, Na+, and Mg2+) to Aromatic Amines (Ph−(CH2)n−NH2,n= 2−5): A Theoretical Study

The Journal of Physical Chemistry A ◽

10.1021/jp811124g ◽

2009 ◽

Vol 113 (18) ◽

pp. 5446-5454 ◽

Cited By ~ 9

Author(s):

J. Srinivasa Rao ◽

G. Narahari Sastry

Keyword(s):

Aromatic Amines ◽

Theoretical Study ◽

Cation Binding

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A theoretical study of the selective alkali and alkaline-earth cation binding properties of valinomycin

International Journal of Quantum Chemistry ◽

10.1002/qua.560200709 ◽

1981 ◽

Vol 20 (S8) ◽

pp. 109-116 ◽

Cited By ~ 24

Author(s):

N. Gresh ◽

C. Etchebest ◽

O. de la Luz Rojas ◽

A. Pullman

Keyword(s):

Alkaline Earth ◽

Theoretical Study ◽

Cation Binding ◽

Binding Properties ◽

Alkaline Earth Cation ◽

Earth Cation

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A theoretical study of the carcinogenic nature of some aromatic amines

Journal of Theoretical Biology ◽

10.1016/0022-5193(80)90353-7 ◽

1980 ◽

Vol 86 (3) ◽

pp. 577-580 ◽

Cited By ~ 2

Author(s):

R.A. Thuraisingham ◽

S.H.M Nilar

Keyword(s):

Aromatic Amines ◽

Theoretical Study

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Theoretical study of the oxidation mechanism of aromatic amines

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29910001437 ◽

1991 ◽

pp. 1437-1443 ◽

Cited By ~ 9

Author(s):

Daniel Larumbe ◽

Miquel Moreno ◽

Iluminada Gallardo ◽

Juan Bertrán ◽

Claude P. Andrieux

Keyword(s):

Aromatic Amines ◽

Theoretical Study ◽

Oxidation Mechanism

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A Theoretical Study of Potassium Cation Binding to Glycylglycine (GG) and Alanylalanine (AA) Dipeptides

Chemistry - A European Journal ◽

10.1002/1521-3765(20021104)8:21<4909::aid-chem4909>3.0.co;2-l ◽

2002 ◽

Vol 8 (21) ◽

pp. 4909-4918 ◽

Cited By ~ 22

Author(s):

Carrie Hoi Shan Wong ◽

Ngai Ling Ma ◽

Chun Wai Tsang

Keyword(s):

Theoretical Study ◽

Cation Binding ◽

Potassium Cation

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Competition betweenπ and Non-π Cation-Binding Sites in Aromatic Amino Acids: A Theoretical Study of Alkali Metal Cation (Li+, Na+, K+)–Phenylalanine Complexes

Chemistry - A European Journal ◽

10.1002/chem.200305519 ◽

2004 ◽

Vol 10 (8) ◽

pp. 1966-1976 ◽

Cited By ~ 31

Author(s):

Fung Ming Siu ◽

Ngai Ling Ma ◽

Chun Wai Tsang

Keyword(s):

Amino Acids ◽

Alkali Metal ◽

Metal Cation ◽

Binding Sites ◽

Theoretical Study ◽

Alkali Metal Cation ◽

Aromatic Amino Acids ◽

Cation Binding

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Ion Transfer of Aromatic Amines on the Water/1,2-Dichloroethane Interface: Theoretical Study

Journal of Solution Chemistry ◽

10.1007/s10953-013-0102-y ◽

2013 ◽

Vol 42 (11) ◽

pp. 2200-2212

Author(s):

Heidy Martínez-Pacheco ◽

Miguel Velázquez-Manzanares ◽

Guillermo Ramírez-Galicia

Keyword(s):

Aromatic Amines ◽

Theoretical Study ◽

Ion Transfer

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Effect of Metal Coordination on the Charge Distribution over the Cation Binding Sites of Zeolites. A Combined Experimental and Theoretical Study

The Journal of Physical Chemistry B ◽

10.1021/jp010098j ◽

2001 ◽

Vol 105 (35) ◽

pp. 8285-8290 ◽

Cited By ~ 36

Author(s):

Judit E. Šponer ◽

Zdeněk Sobalík ◽

Jerzy Leszczynski ◽

Blanka Wichterlová

Keyword(s):

Charge Distribution ◽

Binding Sites ◽

Theoretical Study ◽

Cation Binding ◽

Metal Coordination

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Theoretical study on the mechanisms of the decomposition of nitrate esters and the stabilization of aromatic amines

Journal of Molecular Modeling ◽

10.1007/s00894-019-4245-7 ◽

2019 ◽

Vol 25 (12) ◽

Cited By ~ 2

Author(s):

Yang Sun ◽

Shuang Ni ◽

Xiu-mei Pan

Keyword(s):

Aromatic Amines ◽

Theoretical Study ◽

Nitrate Esters

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Theoretical Study of Plasmon-Enhanced Surface Catalytic Coupling Reactions of Aromatic Amines and Nitro Compounds

The Journal of Physical Chemistry Letters ◽

10.1021/jz5003346 ◽

2014 ◽

Vol 5 (7) ◽

pp. 1259-1266 ◽

Cited By ~ 110

Author(s):

Liu-Bin Zhao ◽

Meng Zhang ◽

Yi-Fan Huang ◽

Christopher T. Williams ◽

De-Yin Wu ◽

...

Keyword(s):

Aromatic Amines ◽

Theoretical Study ◽

Nitro Compounds ◽

Coupling Reactions ◽

Enhanced Surface

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Experimental and theoretical study of the cation binding properties of macrocyclic dehydrodibenzopyrido[15]annulenes

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2014.08.076 ◽

2015 ◽

Vol 137 ◽

pp. 730-739 ◽

Cited By ~ 2

Author(s):

Boris Zimmermann ◽

Goran Baranović ◽

Dubravka Gembarovski

Keyword(s):

Theoretical Study ◽

Cation Binding ◽

Binding Properties

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