Information card for entry 7208021

Structure parameters

• Common name: (Zn2(H2pip)2(bpy))2(H2O)
• Formula: C26 H22 N2 O16 P2 Zn2
• Calculated formula: C26 H18 N2 O16 P2 Zn2
• Title of publication: Syntheses of metal‒organic frameworks with protected phosphonate ligands
• Authors of publication: Yamada, Teppei; Kitagawa, Hiroshi
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 12
• Pages of publication: 4148
• a: 5.136 ± 0.0014 Å
• b: 12.264 ± 0.003 Å
• c: 12.574 ± 0.003 Å
• α: 69.555 ± 0.003°
• β: 79.414 ± 0.003°
• γ: 82.245 ± 0.003°
• Cell volume: 727.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0687
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No