Information card for entry 8105156

Structure parameters

• Formula: C48 H70 Cu N8 O12
• Calculated formula: C48 H70 Cu N8 O12
• Title of publication: Crystal structure of bis(4-phenylpiperazin-1-ium) bis(2-(4-phenylpiperazin-1-yl)succinato-κ2O,O′)copper(II) tetrahydrate, C48H70CuN8O12, [C10H14N2]2[Cu(C14H17N2O4)2] ⋅ 4 H2O
• Authors of publication: Shin, Jiehye; Kang, Jaeun; Ok, Kang Min; Do, Junghwan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 3
• Pages of publication: 511 - 513
• a: 9.4869 ± 0.0001 Å
• b: 11.2213 ± 0.0001 Å
• c: 12.0819 ± 0.0001 Å
• α: 74.608 ± 0.001°
• β: 78.441 ± 0.001°
• γ: 86.82 ± 0.001°
• Cell volume: 1214.9 ± 0.02 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0701
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1114
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No