Information card for entry 7035952

Structure parameters

• Formula: C24 H13 N3 O10 Zn2
• Calculated formula: C24 H12.9999 N3 O9.9999 Zn2
• Title of publication: A hydrothermally stable Zn(ii)-based metal-organic framework: structural modulation and gas adsorption.
• Authors of publication: Zhang, Xiuling; Zhang, Yong-Zheng; Zhang, Da-Shuai; Zhu, Baoyong; Li, Jian-Rong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 35
• Pages of publication: 15697 - 15702
• a: 16.7612 ± 0.0016 Å
• b: 16.7612 ± 0.0016 Å
• c: 6.898 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1678.3 ± 0.3 ų
• Cell temperature: 100 ± 10 K
• Ambient diffraction temperature: 100 ± 10 K
• Number of distinct elements: 5
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.0745
• Residual factor for significantly intense reflections: 0.0711
• Weighted residual factors for significantly intense reflections: 0.1998
• Weighted residual factors for all reflections included in the refinement: 0.2018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No