Information card for entry 4085505

Structure parameters

• Common name: 8
• Formula: C58 H68 N2 O W
• Calculated formula: C58 H68 N2 O W
• SMILES: [W]1(Oc2c(N1c1c(cccc1C(C)C)C(C)C)c1ccccc1c1ccccc21)(=Nc1c(cccc1C(C)C)C(C)C)(CC(C)(C)c1ccccc1)CC(C)(C)c1ccccc1
• Title of publication: Synthesis of Alkyl and Alkylidene Complexes of Tungsten Bearing Imido and Redox-Active α-Diimine oro-Iminoquinone Ligands and Their Application as Catalysts for Ring-Opening Metathesis Polymerization of Norbornene
• Authors of publication: Tanahashi, Hiromasa; Tsurugi, Hayato; Mashima, Kazushi
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 4
• Pages of publication: 731
• a: 12.7709 ± 0.0006 Å
• b: 19.5707 ± 0.0008 Å
• c: 19.8524 ± 0.0009 Å
• α: 90°
• β: 103.811 ± 0.0016°
• γ: 90°
• Cell volume: 4818.4 ± 0.4 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0471
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0908
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No