Information card for entry 7105931

Structure parameters

• Formula: C43.5 H36 F6 Mg N4 O P2
• Calculated formula: C43.5 H36 F6 Mg N4 O P2
• Title of publication: Electrochemical meso-Functionalization of Magnesium(II) Porphine
• Authors of publication: Charles H. Devillers; Abdou K. D. Dime; Helene Cattey; Dominique Lucas
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 1893
• a: 9.4786 ± 0.0004 Å
• b: 25.8868 ± 0.0011 Å
• c: 16.978 ± 0.0007 Å
• α: 90°
• β: 112.241 ± 0.002°
• γ: 90°
• Cell volume: 3856 ± 0.3 ų
• Cell temperature: 115 ± 2 K
• Ambient diffraction temperature: 115 ± 2 K
• Number of distinct elements: 7
• 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: 0.1367
• Residual factor for significantly intense reflections: 0.0904
• Weighted residual factors for significantly intense reflections: 0.1549
• Weighted residual factors for all reflections included in the refinement: 0.1767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No