Information card for entry 7207056

Structure parameters

• Formula: C27 H24 N4 O12 Zn3
• Calculated formula: C27 H22 N4 O12 Zn3
• Title of publication: A series of coordination polymers based on 5,5′-(ethane-1,2-diyl)-bis(oxy)diisophthalic acid and structurally related N-donor ligands: syntheses, structures and properties
• Authors of publication: Kan, Wei-Qiu; Ma, Jian-Fang; Liu, Bo; Yang, Jin
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 1
• Pages of publication: 286
• a: 9.536 ± 0.005 Å
• b: 10.243 ± 0.005 Å
• c: 15.501 ± 0.005 Å
• α: 89.398 ± 0.005°
• β: 76.99 ± 0.005°
• γ: 88.19 ± 0.005°
• Cell volume: 1474.5 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0866
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1014
• Weighted residual factors for all reflections included in the refinement: 0.1183
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No