Information card for entry 4309761

Structure parameters

• Formula: C57 H54 Cl2 Co N4 O12
• Calculated formula: C57 H54 Cl2 Co N4 O12
• Title of publication: Reversible Penta- and Hexacoordination Motifs in [Co(TMPP)] Resulting in Interchange of 1D and 2D Supramolecular Designs
• Authors of publication: Suman Maji; Anil Kumar; Kuntal Pal; Sabyasachi Sarkar
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 7277 - 7279
• a: 22.276 ± 0.005 Å
• b: 8.075 ± 0.005 Å
• c: 29.333 ± 0.005 Å
• α: 90°
• β: 92.088 ± 0.005°
• γ: 90°
• Cell volume: 5273 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.135
• Residual factor for significantly intense reflections: 0.0872
• Weighted residual factors for significantly intense reflections: 0.2077
• Weighted residual factors for all reflections included in the refinement: 0.2312
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No