Information card for entry 7708262

Structure parameters

• Formula: C23 H35 Mn O3 P2
• Calculated formula: C23 H35 Mn O3 P2
• Title of publication: Manganese and Iron PCP Pincer Complexes ‒ The Influence of Sterics on Structure and Reactivity
• Authors of publication: Eder, Wolfgang; Himmelbauer, Daniel; Stöger, Berthold; Veiros, Luis F.; Pignitter, Marc; Kirchner, Karl
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 10.6082 ± 0.0002 Å
• b: 15.4709 ± 0.0003 Å
• c: 28.6193 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4696.95 ± 0.15 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0696
• Weighted residual factors for all reflections included in the refinement: 0.0746
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No