Information card for entry 4348099

Structure parameters

• Formula: C20 H12 Cu N4
• Calculated formula: C20 H12 Cu N4
• Title of publication: Metalloporphines: Dimers and Trimers.
• Authors of publication: Jentzen, Walter; Shelnutt, John A.; Scheidt, W. Robert
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 12
• Pages of publication: 6294 - 6299
• a: 10.0385 ± 0.0005 Å
• b: 12.5993 ± 0.0004 Å
• c: 14.775 ± 0.0011 Å
• α: 99.691 ± 0.014°
• β: 92.907 ± 0.004°
• γ: 98.851 ± 0.006°
• Cell volume: 1814.47 ± 0.19 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1056
• Residual factor for significantly intense reflections: 0.0713
• Weighted residual factors for significantly intense reflections: 0.1183
• Weighted residual factors for all reflections included in the refinement: 0.1307
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No