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(3aR*,8bR*)-3a,8b-Dihydroxy-1-(4-methylphenyl)-2-methylsulfanyl-3-nitro-1,8b-dihydroindeno[1,2-b]pyrrol-4(3aH)-one
The asymmetric unit of the title compound, C(19)H(16)N(2)O(5)S, contains four independent molecules (A, B, C and D), with two molecules (B and D) displaying disorder in their methylsulfanyl groups [occupancy ratios of 0.797 (11):0.203 (11) and 0.85 (2):0.15 (2)]. The nitro groups are twisted slig...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998437/ https://www.ncbi.nlm.nih.gov/pubmed/24764991 http://dx.doi.org/10.1107/S1600536814002712 |
Sumario: | The asymmetric unit of the title compound, C(19)H(16)N(2)O(5)S, contains four independent molecules (A, B, C and D), with two molecules (B and D) displaying disorder in their methylsulfanyl groups [occupancy ratios of 0.797 (11):0.203 (11) and 0.85 (2):0.15 (2)]. The nitro groups are twisted slightly out of the planes of the 2-pyrroline rings to which they are bonded with dihedral angles of 10.17 (1), 8.01 (1), 9.44 (1) and 8.87 (1)° in molecules A, B, C and D, respectively. The 2-pyrroline rings are almost orthogonal to the attached tolyl rings, forming dihedral angles of 73.44 (1), 81.21 (1), 88.18 (8) and 73.94 (1)° for molecules A, B, C and D, respectively. A weak intramolecular O—H⋯O interaction is observed in molecules B and C. The two hydroxy groups in each molecule are involved in intermolecular O—H⋯O hydrogen bonding. In the crystal, molecules are connected via O—H⋯O and C—H⋯O hydrogen bonds, forming a complex three-dimensional network. |
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