Information card for entry 8106453

Structure parameters

• Formula: C30 H30 N4 Ni O5 Si
• Calculated formula: C30 H30 N4 Ni O5 Si
• Title of publication: Crystal structure of catena-poly-{aqua-[μ2-1,2-bis((1H-imidazol-1-yl)methyl)benzene-κ2 N:N′]-[μ2-4,4′-(dimethylsilanediyl)dibenzato-κ3 O,O′:O′]nickel(II)}, C30H30N4NiO5Si
• Authors of publication: Cai, Yan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 1
• Pages of publication: 121 - 123
• a: 8.6296 ± 0.0004 Å
• b: 12.9969 ± 0.0006 Å
• c: 14.8944 ± 0.0006 Å
• α: 114.863 ± 0.001°
• β: 90.896 ± 0.001°
• γ: 105.37 ± 0.001°
• Cell volume: 1445.99 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0329
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0735
• Weighted residual factors for all reflections included in the refinement: 0.0818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No