Information card for entry 7202079

Structure parameters

• Formula: C68 H74 Cl2 Cu4 N8 O13
• Calculated formula: C68 H64 Cl2 Cu4 N8 O13
• Title of publication: Two 3D hybrid networks of mog and bcu topology constructed with copper(I/I,II) halides and N,N′-spacers
• Authors of publication: Hao, Hong-Qing; Wang, Jing; Liu, Wen-Ting; Tong, Ming-Liang
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 10
• Pages of publication: 1454
• a: 15.5963 ± 0.0002 Å
• b: 9.1944 ± 0.0001 Å
• c: 24.2176 ± 0.0002 Å
• α: 90°
• β: 101.474 ± 0.001°
• γ: 90°
• Cell volume: 3403.37 ± 0.06 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.06
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.1245
• Weighted residual factors for all reflections included in the refinement: 0.1311
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No