Literature DB >> 16679608

A three-dimensional framework of pi-stacked hydrogen-bonded chains in benzyl 4-chloro-3-nitrobenzoate, and chains of hydrogen-bonded rings in benzyl 4-nitrobenzoate, redetermined at 120 K.

Marcus V N de Souza1, Thatyana R A Vasconcelos, Solange M S V Wardell, James L Wardell, John N Low, Christopher Glidewell.   

Abstract

Benzyl 4-chloro-3-nitrobenzoate, C14H10ClNO4, crystallizes with Z' = 2 in the space group P-1. The molecules are linked by three independent C-H...O hydrogen bonds into chains of edge-fused R(4)4 (26) and R(4)4 (34) rings, and these chains are linked into a three-dimensional framework structure by aromatic pi-pi stacking interactions. In benzyl 4-nitrobenzoate, C14H11NO4, the molecules are linked by two independent C-H...O hydrogen bonds into chains containing two types of R(2)2 (10) ring.

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Year:  2006        PMID: 16679608     DOI: 10.1107/S0108270106008535

Source DB:  PubMed          Journal:  Acta Crystallogr C        ISSN: 0108-2701            Impact factor:   1.172


  1 in total

1.  Methyl 4-chloro-3-nitro-benzoate.

Authors:  Bo-Nian Liu; Shi-Gui Tang; Hao-Yuan Li; Ye-Ming Xu; Cheng Guo
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2008-01-16
  1 in total

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