Information card for entry 4123297

Structure parameters

• Formula: C114 H126 N6 W
• Calculated formula: C114 H126 N6 W
• Title of publication: Bespoke photoreductants: tungsten arylisocyanides.
• Authors of publication: Sattler, Wesley; Henling, Lawrence M.; Winkler, Jay R.; Gray, Harry B.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 3
• Pages of publication: 1198 - 1205
• a: 14.456 ± 0.003 Å
• b: 18.045 ± 0.003 Å
• c: 18.803 ± 0.004 Å
• α: 85.655 ± 0.006°
• β: 87.973 ± 0.006°
• γ: 81.028 ± 0.005°
• Cell volume: 4829.6 ± 1.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1583
• Residual factor for significantly intense reflections: 0.0776
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.35
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No