Information card for entry 7114229

Structure parameters

• Formula: C88 H96 F48 N8 O8 W4
• Calculated formula: C88 H96 F48 N8 O8 W4
• Title of publication: Structure and reactivity studies of the first tungsten cyanoalkylidene complexElectronic supplementary information (ESI) available: experimental details. See http://www.rsc.org/suppdata/cc/b2/b202110b/
• Authors of publication: Cameron, Thomas M.; Gamble, A. Scott; Abboud, Khalil A.; Boncella, James M.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 10
• Pages of publication: 1148
• a: 29.517 ± 0.009 Å
• b: 12.674 ± 0.004 Å
• c: 29.558 ± 0.009 Å
• α: 90°
• β: 90.982 ± 0.005°
• γ: 90°
• Cell volume: 11056 ± 6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No