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9-O-Ethylberberrubinium iodide monohydrate
In the title compound (systematic name: 9-ethoxy-10-methoxy-5,6-dihydro-1,3-dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-7-ium iodide monohydrate), 2C(21)H(20)NO(4) (+)·2I(−)·H(2)O, two independent molecules pack in the unit cell, where interactions between the molecules are stabilized by weak...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983369/ https://www.ncbi.nlm.nih.gov/pubmed/21587567 http://dx.doi.org/10.1107/S1600536810036664 |
Sumario: | In the title compound (systematic name: 9-ethoxy-10-methoxy-5,6-dihydro-1,3-dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-7-ium iodide monohydrate), 2C(21)H(20)NO(4) (+)·2I(−)·H(2)O, two independent molecules pack in the unit cell, where interactions between the molecules are stabilized by weak intermolecular π–π stacking interactions [centroid–centroid distances in the range 3.571 (4) to 3.815 (4)Å]. Intermolecular C—H⋯O interactions are also observed. The iodide anions are disordered with occupancy ratios of 0.94 (1):0.06 (1) and 0.91 (1):0.09 (1). The cationic molecule is planar in structure with a small torsion resulting from the dihydropyridine ring. |
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