Information card for entry 7102779

Structure parameters

• Formula: C40 H58 Cu3 N16 O27 V10
• Calculated formula: C40 H56 Cu3 N16 O27 V10
• Title of publication: Spontaneous resolution of a 3D chiral polyoxometalate-based polythreaded framework consisting of an achiral ligand
• Authors of publication: Lan, Ya-Qian; Li, Shun-Li; Su, Zhong-Min; Shao, Kui-Zhan; Ma, Jian-Fang; Wang, Xin-Long; Wang, En-Bo
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2008
• Journal issue: 1
• Pages of publication: 58 - 60
• a: 23.067 ± 0.001 Å
• b: 23.176 ± 0.001 Å
• c: 24.948 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13337.2 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 23
• Hermann-Mauguin space group symbol: I 2 2 2
• Hall space group symbol: I 2 2
• Residual factor for all reflections: 0.079
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1121
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No