Information card for entry 7208019

Structure parameters

• Common name: dizinc 4,4'-bipyridyl bis(3-etacarboxy-5-carboxylphoshonate trihydrate
• Chemical name: dizinc 4,4'-bipyridyl bis(3-etacarboxy-5-carboxylphoshonate trihydrate
• Formula: C16 H21 N O10 P Zn
• Calculated formula: C16 H21 N O10 P Zn
• 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: 8.463 ± 0.002 Å
• b: 11.263 ± 0.003 Å
• c: 11.774 ± 0.003 Å
• α: 110.96 ± 0.002°
• β: 96.523 ± 0.003°
• γ: 108.941 ± 0.002°
• Cell volume: 957.2 ± 0.4 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: 0.0268
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0755
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No