Crystal Structure Of (3e)-3-(2,4-di-nitro-phen-oxy-meth-yl)-4-phenyl-but-3-en-2-one.
Contribuinte(s) |
UNIVERSIDADE DE ESTADUAL DE CAMPINAS |
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Data(s) |
01/09/2014
27/11/2015
27/11/2015
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Resumo |
In the title compound, C17H14N2O6, the conformation about the C=C double bond [1.345 (2) Å] is E, with the ketone moiety almost coplanar [C-C-C-C torsion angle = 9.5 (2)°] along with the phenyl ring [C-C-C-C = 5.9 (2)°]. The aromatic rings are almost perpendicular to each other [dihedral angle = 86.66 (7)°]. The 4-nitro moiety is approximately coplanar with the benzene ring to which it is attached [O-N-C-C = 4.2 (2)°], whereas the one in the ortho position is twisted [O-N-C-C = 138.28 (13)°]. The mol-ecules associate via C-H⋯O inter-actions, involving both O atoms from the 2-nitro group, to form a helical supra-molecular chain along [010]. Nitro-nitro N⋯O inter-actions [2.8461 (19) Å] connect the chains into layers that stack along [001]. 70 o1051-2 |
Identificador |
Acta Crystallographica. Section E, Structure Reports Online. v. 70, n. Pt 9, p. o1051-2, 2014-Sep. 1600-5368 10.1107/S1600536814018819 http://www.ncbi.nlm.nih.gov/pubmed/25309220 http://repositorio.unicamp.br/jspui/handle/REPOSIP/201803 25309220 |
Idioma(s) |
eng |
Relação |
Acta Crystallographica. Section E, Structure Reports Online Acta Crystallogr Sect E Struct Rep Online |
Direitos |
aberto |
Fonte |
PubMed |
Palavras-Chave | #N⋯o Interactions #Crystal Structure #Hydrogen Bonding |
Tipo |
Artigo de periódico |