Information card for entry 8107350

Structure parameters

• Formula: C31 H28 Cl Cu N7 O7
• Calculated formula: C31 H28 Cl Cu N7 O7
• Title of publication: The crystal structure of (tris(2-benzimidazolylmethyl)amine)-benzoato-copper(II) perchlorate monohydrate, CuC31H28N7O7Cl
• Authors of publication: Li, Ji; Miao, Mingzhi
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 1
• Pages of publication: 51 - 53
• a: 10.1386 ± 0.0006 Å
• b: 12.1155 ± 0.0008 Å
• c: 14.1972 ± 0.0008 Å
• α: 100.297 ± 0.002°
• β: 98.411 ± 0.002°
• γ: 112.774 ± 0.003°
• Cell volume: 1536.78 ± 0.17 ų
• Cell temperature: 250 K
• Ambient diffraction temperature: 250 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0911
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.137
• Weighted residual factors for all reflections included in the refinement: 0.1519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No