Information card for entry 7225724

Structure parameters

• Formula: C36 H34 B Cu N12 O42 W12
• Calculated formula: C36 H30 B Cu N12 O40 W12
• Title of publication: The factors affecting the assembly of Keggin‒metal‒bimb systems: charge/polarity of Keggin polyanions and coordination modes of metal cations
• Authors of publication: Zhao, Chunyan; Li, Shaobin; Ma, Huiyuan; Zhang, Chunjing; Pang, Haijun; Yu, Yan; Zhang, Zhuanfang
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 33
• Pages of publication: 6233
• a: 11.2301 ± 0.0006 Å
• b: 12.9434 ± 0.0007 Å
• c: 13.2453 ± 0.0008 Å
• α: 96.455 ± 0.001°
• β: 113.462 ± 0.001°
• γ: 104.427 ± 0.001°
• Cell volume: 1661.18 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0828
• Residual factor for significantly intense reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.1455
• Weighted residual factors for all reflections included in the refinement: 0.1525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.161
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No