Information card for entry 7217293

Structure parameters

• Formula: C19.5 H27.5 Cl2 Mn N5 O1.5
• Calculated formula: C19.5 H27.5 Cl2 Mn N5 O1.5
• Title of publication: Metal ionic size directed complexation in manganese(II) coordination chemistry: Efficient candidates showing phenoxazinone synthase mimicking activity
• Authors of publication: Panja, Anangamohan
• Journal of publication: RSC Advances
• Year of publication: 2014
• a: 10.4242 ± 0.0002 Å
• b: 9.1757 ± 0.0001 Å
• c: 24.4086 ± 0.0005 Å
• α: 90°
• β: 100.971 ± 0.001°
• γ: 90°
• Cell volume: 2292 ± 0.07 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0786
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1315
• Weighted residual factors for all reflections included in the refinement: 0.1463
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No