Information card for entry 7243717

Structure parameters

• Common name: clopamide copper(II) diprophanol dihydrate
• Chemical name: trans-bis(4-chloro-N-(2,6-dimethylpiperidin-1-yl)-3-sulfamoylbenzamide)-copper(II) diprophanol solvate dihydrate
• Formula: C34 H58 Cl2 Cu N6 O10 S2
• Calculated formula: C34 H58 Cl2 Cu N6 O10 S2
• Title of publication: Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals
• Authors of publication: Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 42
• Pages of publication: 7425 - 7441
• a: 8.497 ± 0.005 Å
• b: 8.404 ± 0.004 Å
• c: 16.31 ± 0.008 Å
• α: 83.113 ± 0.012°
• β: 79.445 ± 0.01°
• γ: 67.366 ± 0.01°
• Cell volume: 1055.2 ± 1 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1149
• Residual factor for significantly intense reflections: 0.0856
• Weighted residual factors for significantly intense reflections: 0.2121
• Weighted residual factors for all reflections included in the refinement: 0.2365
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No