Information card for entry 4343187

Structure parameters

• Common name: trans-Mo(N2)2(PMePh2)2(P_Et2-PN2, N_iPr2)
• Formula: C46 H72 Mo N6 P4
• Calculated formula: C46 H72 Mo N6 P4
• Title of publication: Electronic and Steric Influences of Pendant Amine Groups on the Protonation of Molybdenum Bis(dinitrogen) Complexes.
• Authors of publication: Labios, Liezel A.; Heiden, Zachariah M.; Mock, Michael T.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 9
• Pages of publication: 4409 - 4422
• a: 10.4421 ± 0.0013 Å
• b: 41.057 ± 0.004 Å
• c: 12.0755 ± 0.0015 Å
• α: 90°
• β: 110.658 ± 0.006°
• γ: 90°
• Cell volume: 4844.2 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0549
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No