Information card for entry 7049177

Structure parameters

• Formula: C35 H36 B2 Cl2 F5 Mo N3 O4 P2
• Calculated formula: C35 H36 B2 Cl2 F5 Mo N3 O4 P2
• Title of publication: Isolation of ligand-centered borocations in molybdenum complexes containing a triaminoborane-bridged diphosphorus ligand.
• Authors of publication: Lee, Kyounghoon; Kim, Chan Woo; Buckley, Jimmy L.; Vlaisavljevich, Bess; Daly, Scott R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 11
• Pages of publication: 3777 - 3785
• a: 20.655 ± 0.002 Å
• b: 11.0271 ± 0.0011 Å
• c: 17.7885 ± 0.0018 Å
• α: 90°
• β: 107.133 ± 0.005°
• γ: 90°
• Cell volume: 3871.8 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 9
• 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: 0.1076
• Residual factor for significantly intense reflections: 0.0733
• Weighted residual factors for significantly intense reflections: 0.1755
• Weighted residual factors for all reflections included in the refinement: 0.1983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No