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N′-[(E)-4-Bromobenzylidene]-2-(4-isobutylphenyl)propanohydrazide
The asymmetric unit of the title compound, C(20)H(23)BrN(2)O, contains two independent molecules (A and B), in which the orientations of the 4-isobutylphenyl units are different. The dihedral angle between the two benzene rings is 88.45 (8)° in molecule A and 89.87 (8)° in molecule B. Molecules...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969560/ https://www.ncbi.nlm.nih.gov/pubmed/21583058 http://dx.doi.org/10.1107/S1600536809015542 |
Sumario: | The asymmetric unit of the title compound, C(20)H(23)BrN(2)O, contains two independent molecules (A and B), in which the orientations of the 4-isobutylphenyl units are different. The dihedral angle between the two benzene rings is 88.45 (8)° in molecule A and 89.87 (8)° in molecule B. Molecules A and B are linked by a C—H⋯N hydrogen bond. In the crystal, molecules are linked into chains running along the a axis by intermolcular N—H⋯O and C—H⋯O hydrogen bonds. The crystal structure is further stabilized by C—H⋯π interactions. The presence of pseudosymmetry in the structure suggests the higher symmetry space group Pbca. However, attempts to refine the structure in this space group resulted in a disorder model with high R (0.097) and wR (0.257) values. The crystal studied was an inversion twin with a 0.595 (4):0.405 (4) domain ratio. |
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