Information card for entry 8104618

Structure parameters

• Formula: C30 H25 Cd N11 O8
• Calculated formula: C30 H25 Cd N11 O8
• Title of publication: Crystal structure of catena-poly[bis(µ2-3,5-bis(1-imidazolyl)pyridine-κ2 N:N′)-(µ2-3-nitrophthalato-k3 O,O′:O″)cadmium(II)] dihydrate, C30H25N11O8Cd
• Authors of publication: Yin, Wei-Dong; Liu, Qian-Long; Zhao, Ya-Jing; Gong, Xiao-Ru; Li, Gui-Lian
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 5
• Pages of publication: 899 - 902
• a: 17.9344 ± 0.0003 Å
• b: 18.2722 ± 0.0003 Å
• c: 9.5619 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3133.44 ± 0.1 ų
• Cell temperature: 293.28 ± 0.1 K
• Ambient diffraction temperature: 293.28 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.0707
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No