Information card for entry 7048821

Structure parameters

• Formula: C59 H48 Mo N2 P5
• Calculated formula: C59 H48 Mo N2 P5
• Title of publication: Molybdenum dinitrogen complex supported by a cyclohexane-based triphosphine ligand and dmpm.
• Authors of publication: Weyrich, Thomas; Krahmer, Jan; Engesser, Tobias A.; Näther, Christian; Tuczek, Felix
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 18
• Pages of publication: 6019 - 6025
• a: 12.9372 ± 0.0004 Å
• b: 22.1222 ± 0.0005 Å
• c: 19.5024 ± 0.0007 Å
• α: 90°
• β: 108.947 ± 0.003°
• γ: 90°
• Cell volume: 5279.2 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• 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: 0.0862
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.144
• Weighted residual factors for all reflections included in the refinement: 0.1587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No