Information card for entry 2011403

Structure parameters

• Formula: C36 H44 Ca N2 O12 Zn2
• Calculated formula: C36 H44 Ca N2 O12 Zn2
• Title of publication: Two mixed-metal carboxylate‒base adducts
• Authors of publication: Cui, Yong; Zhang, Xing; Zheng, Fakun; Ren, Jing; Chen, Gang; Qian, Yitai; Huang, Jinshun
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 10
• Pages of publication: 1198 - 1200
• a: 8.614 ± 0.002 Å
• b: 19.363 ± 0.004 Å
• c: 12.473 ± 0.003 Å
• α: 90°
• β: 95.59 ± 0.03°
• γ: 90°
• Cell volume: 2070.5 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.062
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes