Information card for entry 2004581

Structure parameters

• Chemical name: Ethanol-(2,3,7,8,12,13,17,18-Octaethylporphinato)manganese(III) Perchlorate
• Formula: C38 H50 Cl Mn N4 O5
• Calculated formula: C38 H46 Cl Mn N4 O5
• Title of publication: (Ethanol)(2,3,7,8,12,13,17,18-octaethylporphinato)manganese(III) Perchlorate
• Authors of publication: Cheng, B.; Scheidt, W. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 585 - 588
• a: 12.8859 ± 0.0004 Å
• b: 12.9276 ± 0.001 Å
• c: 13.5328 ± 0.0007 Å
• α: 64.067 ± 0.009°
• β: 87.82 ± 0.006°
• γ: 67.207 ± 0.006°
• Cell volume: 1845.4 ± 0.3 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: 0.0856
• Residual factor for significantly intense reflections: 0.0672
• Weighted residual factors for all reflections: 0.1905
• Weighted residual factors for significantly intense reflections: 0.1767
• Goodness-of-fit parameter for all reflections: 1.053
• Goodness-of-fit parameter for significantly intense reflections: 1.106
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No