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Methyl 2-[(methylsulfonyl)(propyl)amino]benzoate
The asymmetric unit of the title compound, C(12)H(17)NO(4)S, contains two molecules, both of which show disorder of the two terminal C atoms of the propyl chain over two sets of sites with an occupancy ratio of 0.581 (6):0.419 (6). Intramolecular C—H⋯O interactions help to establish the molecula...
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/PMC2980136/ https://www.ncbi.nlm.nih.gov/pubmed/21580129 http://dx.doi.org/10.1107/S1600536809054920 |
Sumario: | The asymmetric unit of the title compound, C(12)H(17)NO(4)S, contains two molecules, both of which show disorder of the two terminal C atoms of the propyl chain over two sets of sites with an occupancy ratio of 0.581 (6):0.419 (6). Intramolecular C—H⋯O interactions help to establish the molecular conformations: in one molecule, the dihedral angle between the methyl ester group and the benzene ring is 41.0 (2)°, whereas in the other molecule it is 36.12 (17)°. In the crystal, molecules are linked by intermolecular C—H⋯O and C—H⋯π interactions. |
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