Information card for entry 7212744

Structure parameters

• Formula: C21 H21 As I2
• Calculated formula: C21 H21 As I2
• SMILES: c1(c(cccc1)C)[As](c1c(cccc1)C)(c1c(cccc1)C)[I]I
• Title of publication: Structural relationships between o-, m- and p-tolyl substituted R3EI2 (E = As, P) and [(R3E)AuX] (E = As, P; X = Cl, Br, I)
• Authors of publication: Barnes, Nicholas A.; Flower, Kevin R.; Godfrey, Stephen M.; Hurst, Paul A.; Khan, Rana Z.; Pritchard, Robin G.
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 12
• Pages of publication: 4240
• a: 9.2609 ± 0.0002 Å
• b: 11.1853 ± 0.0003 Å
• c: 11.6126 ± 0.0003 Å
• α: 61.935 ± 0.001°
• β: 89.574 ± 0.001°
• γ: 88.945 ± 0.002°
• Cell volume: 1061.28 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.097
• Residual factor for significantly intense reflections: 0.0673
• Weighted residual factors for significantly intense reflections: 0.1538
• Weighted residual factors for all reflections included in the refinement: 0.1791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No