Information card for entry 7049374

Structure parameters

• Formula: C20 H14 Br Mn N4 O3
• Calculated formula: C20 H14 Br Mn N4 O3
• Title of publication: Cooperative Mn(i)-complex catalyzed transfer hydrogenation of ketones and imines.
• Authors of publication: Ganguli, Kasturi; Shee, Sujan; Panja, Dibyajyoti; Kundu, Sabuj
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 21
• Pages of publication: 7358 - 7366
• a: 14.652 ± 0.0013 Å
• b: 29.737 ± 0.003 Å
• c: 10.2242 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4454.8 ± 0.7 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0806
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1121
• Weighted residual factors for all reflections included in the refinement: 0.1292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No