Information card for entry 7249808

Structure parameters

• Formula: C42 H26 Cl4 N6 Ni O9
• Calculated formula: C42 H26 Cl4 N6 Ni O9
• Title of publication: Structural analysis and water adsorption properties of chloranilate anion–terpyridine metal complexes forming hydrogen-bonded frameworks
• Authors of publication: Mishima, Akio; Mori, Runa; Kanazashi, Ken; Hamaguchi, Tomohiko; Ishikawa, Ryuta; Kawata, Satoshi
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 7
• Pages of publication: 931 - 938
• a: 8.9581 ± 0.0003 Å
• b: 11.035 ± 0.0003 Å
• c: 20.9833 ± 0.0005 Å
• α: 85.086 ± 0.002°
• β: 80.136 ± 0.002°
• γ: 85.18 ± 0.002°
• Cell volume: 2030.99 ± 0.1 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.0557
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1013
• Weighted residual factors for all reflections included in the refinement: 0.1071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No