Information card for entry 4502365

Structure parameters

• Formula: C36 H29 Cd N7 O4
• Calculated formula: C36 H29 Cd N7 O4
• Title of publication: Metal−Organic Frameworks Based on Different Benzimidazole Derivatives: Effect of Length and Substituent Groups of the Ligands on the Structures
• Authors of publication: Li, Shun-Li; Lan, Ya-Qian; Ma, Ji-Cheng; Ma, Jian-Fang; Su, Zhong-Min
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 3
• Pages of publication: 1161
• a: 8.097 ± 0.0006 Å
• b: 20.411 ± 0.0015 Å
• c: 19.533 ± 0.0016 Å
• α: 90°
• β: 99.436 ± 0.002°
• γ: 90°
• Cell volume: 3184.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0963
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.1028
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No