Information card for entry 4348487

Structure parameters

• Formula: C75.29 H64.06 Cl2.7 Mn N7 O10.39
• Calculated formula: C75.286 H64.0568 Cl2.7 Mn N7 O10.386
• Title of publication: The Influence of Peripheral Substituent Modification on P(V), Mn(III), and Mn(V)(O) Corrolazines: X-ray Crystallography, Electrochemical and Spectroscopic Properties, and HAT and OAT Reactivities.
• Authors of publication: Joslin, Evan E.; Zaragoza, Jan Paulo T.; Baglia, Regina A.; Siegler, Maxime A.; Goldberg, David P.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 17
• Pages of publication: 8646 - 8660
• a: 10.0064 ± 0.0005 Å
• b: 18.3946 ± 0.0009 Å
• c: 19.5794 ± 0.0009 Å
• α: 69.721 ± 0.004°
• β: 86.165 ± 0.004°
• γ: 80.387 ± 0.004°
• Cell volume: 3332.8 ± 0.3 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 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: 0.092
• Residual factor for significantly intense reflections: 0.0695
• Weighted residual factors for significantly intense reflections: 0.1949
• Weighted residual factors for all reflections included in the refinement: 0.2181
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No