Information card for entry 7717421

Structure parameters

• Formula: C38 H36 B F4 Mn N O2 P3
• Calculated formula: C38 H36 B F4 Mn N O2 P3
• Title of publication: Influence of triphosphine ligand coordination geometry in Mn(I) hydride complexes [(P^∩P^∩P)(CO)₂MnH] on their kinetic hydricity.
• Authors of publication: Kovalenko, Sergey A.; Gulyaeva, Ekaterina S.; Osipova, Elena S.; Filippov, Oleg A.; Danshina, Anastasia A.; Vendier, Laure; Kireev, Nikolay V.; Godovikov, Ivan A.; Canac, Yves; Valyaev, Dmitry A.; Belkova, Natalia V.; Shubina, Elena S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 54
• Journal issue: 1
• Pages of publication: 122 - 132
• a: 10.0848 ± 0.0002 Å
• b: 12.377 ± 0.0003 Å
• c: 14.8709 ± 0.0003 Å
• α: 75.639 ± 0.001°
• β: 84.243 ± 0.001°
• γ: 85.386 ± 0.001°
• Cell volume: 1786.13 ± 0.07 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0805
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No