Information card for entry 7249807

Structure parameters

• Formula: C36 H34 Cl1.99 N6 Ni O10.01
• Calculated formula: C36 H34 Cl1.985 N6 Ni O10
• 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: 9.0426 ± 0.0002 Å
• b: 9.0675 ± 0.0003 Å
• c: 22.4477 ± 0.0006 Å
• α: 92.511 ± 0.002°
• β: 96.2 ± 0.002°
• γ: 90.655 ± 0.002°
• Cell volume: 1827.81 ± 0.09 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: 0.0847
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.1185
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No