Information card for entry 1567403

Structure parameters

• Common name: Mo-8
• Formula: C53 H44 Al Cl F41 Mo N2 O7
• Calculated formula: C53 H44 Al Cl F41 Mo N2 O7
• Title of publication: Cationic molybdenum oxo alkylidenes stabilized by N-heterocyclic carbenes: from molecular systems to efficient supported metathesis catalysts
• Authors of publication: Musso, Janis V.; De Jesus Silva, Jordan; Benedikter, Mathis J.; Groos, Jonas; Frey, Wolfgang; Copéret, Christophe; Buchmeiser, Michael R.
• Journal of publication: Chemical Science
• Year of publication: 2022
• Journal volume: 13
• Journal issue: 29
• Pages of publication: 8649 - 8656
• a: 12.9654 ± 0.0008 Å
• b: 13.8876 ± 0.0009 Å
• c: 19.3009 ± 0.0012 Å
• α: 79.898 ± 0.002°
• β: 78.994 ± 0.002°
• γ: 86.057 ± 0.003°
• Cell volume: 3356.2 ± 0.4 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 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: 0.0914
• Residual factor for significantly intense reflections: 0.0718
• Weighted residual factors for significantly intense reflections: 0.174
• Weighted residual factors for all reflections included in the refinement: 0.1845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No