Information card for entry 1519119

Structure parameters

• Formula: C24 H20 As I2 N O3 W
• Calculated formula: C24 H20 As I2 N O3 W
• SMILES: [W](I)(I)([As](c1ccccc1)(c1ccccc1)c1ccccc1)([N]#CCC)(C#[O])(C#[O])C#[O]
• Title of publication: C24H20AsI2NO3W
• Authors of publication: Baker, Paul K.; Hursthouse, Michael B.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 1992
• Pages of publication: 1184
• a: 11.465 ± 0.003 Å
• b: 11.129 ± 0.002 Å
• c: 20.95 ± 0.002 Å
• α: 90°
• β: 105.335 ± 0.005°
• γ: 90°
• Cell volume: 2577.9 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0523
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.1241
• Weighted residual factors for all reflections included in the refinement: 0.1284
• Goodness-of-fit parameter for all reflections included in the refinement: 0.824
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No