Information card for entry 1567402

Structure parameters

• Common name: Mo-2
• Formula: C37 H30 Cl2 F18 Mo N2 O4
• Calculated formula: C37 H30 Cl2 F18 Mo N2 O4
• 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: 11.8411 ± 0.0006 Å
• b: 12.4718 ± 0.0007 Å
• c: 15.3713 ± 0.0008 Å
• α: 80.252 ± 0.002°
• β: 81.208 ± 0.002°
• γ: 66.112 ± 0.003°
• Cell volume: 2036.64 ± 0.19 ų
• Cell temperature: 135 ± 2 K
• Ambient diffraction temperature: 135 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0602
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.1401
• Weighted residual factors for all reflections included in the refinement: 0.1443
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No