Information card for entry 4339096

Structure parameters

• Formula: C12 H18 Mn N5 O2
• Calculated formula: C12 H18 Mn N5 O2
• Title of publication: Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.
• Authors of publication: Darensbourg, Donald J.; Frantz, Eric B.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 15
• Pages of publication: 5967 - 5978
• a: 10.2639 ± 0.0011 Å
• b: 13.5749 ± 0.0015 Å
• c: 11.3173 ± 0.0011 Å
• α: 90°
• β: 112.173 ± 0.006°
• γ: 90°
• Cell volume: 1460.2 ± 0.3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• 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: 0.0721
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1013
• Weighted residual factors for all reflections included in the refinement: 0.1057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No