Information card for entry 7717366

Structure parameters

• Formula: C49 H63 Mo N4 O3
• Calculated formula: C49 H63 Mo N4 O3
• Title of publication: Synthesis and electrochemical properties of molybdenum nitrido complexes supported by redox-active NHC and MIC ligands.
• Authors of publication: Leitner, Daniel; Neururer, Florian R.; Hohloch, Stephan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 2
• Pages of publication: 582 - 594
• a: 12.3406 ± 0.0006 Å
• b: 13.6168 ± 0.0007 Å
• c: 15.6475 ± 0.0009 Å
• α: 95.467 ± 0.002°
• β: 107.91 ± 0.002°
• γ: 109.9 ± 0.002°
• Cell volume: 2293.1 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0552
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1015
• Weighted residual factors for all reflections included in the refinement: 0.1114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No