Information card for entry 8102645

Structure parameters

• Formula: C6 H10 Cl2 Cu N4
• Calculated formula: C6 H10 Cl2 Cu N4
• Title of publication: Crystal structure of catena-[tetrachloro-bis(1,5-pentamethylene-1H-tetrazole)copper(II)], Cu2Cl4(C6H10N4)2
• Authors of publication: Min Hu; Qiang Zhang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 1
• Pages of publication: 153
• a: 6.8953 ± 0.0003 Å
• b: 16.4266 ± 0.0006 Å
• c: 8.6791 ± 0.0004 Å
• α: 90°
• β: 108.814 ± 0.004°
• γ: 90°
• Cell volume: 930.53 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0408
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0423
• Weighted residual factors for all reflections included in the refinement: 0.0434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No