Theoretical calculations of chemical interactions-111. The reaction of halonitrobenzenes with nucleophiles

Potential o-zwitterionic complexes formed between fluorobenzene, p- and o-nitrofluorobenzene with ammonia and amide ion where calculated by CNDU, INDO and MNDO semiempirical methods with a wide geometry optimization. Data for bond lengths, bond angles and charge densities are given. In the case of t...

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Detalles Bibliográficos
Autores principales:	Nudelman, N.S., Mac Cormack, P.
Formato:	JOUR
Acceso en línea:	http://hdl.handle.net/20.500.12110/paper_00404020_v40_n21_p4227_Nudelman
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

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