Information card for entry 7205778

Structure parameters

• Formula: C14 H14 Cu Mo3 N4 O9.5
• Calculated formula: C14 H14 Cu Mo3 N4 O9.5
• Title of publication: Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
• Authors of publication: Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 10
• Pages of publication: 3526
• a: 9.824 ± 0.005 Å
• b: 10.017 ± 0.006 Å
• c: 11.36 ± 0.007 Å
• α: 111.68 ± 0.02°
• β: 96.45 ± 0.02°
• γ: 94.56 ± 0.02°
• Cell volume: 1023.3 ± 1 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 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: 0.0384
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0777
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No