Information card for entry 1519143

Structure parameters

• Formula: C21 H24 I2 O S3 W
• Calculated formula: C21 H24 I2 O S3 W
• Title of publication: C21H24I2OS3W
• Authors of publication: Baker, Paul K.; Coles, Simon J.; Hursthouse, Michael B.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 1994
• Pages of publication: 1199
• a: 8.4576 ± 0.0019 Å
• b: 13.494 ± 0.012 Å
• c: 22.03 ± 0.02 Å
• α: 90°
• β: 99.48 ± 0.08°
• γ: 90°
• Cell volume: 2480 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• 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: 0.0599
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0692
• Weighted residual factors for all reflections included in the refinement: 0.0731
• Goodness-of-fit parameter for all reflections included in the refinement: 0.776
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No