Information card for entry 7104152

Structure parameters

• Formula: C37 H51 As I2 N2 O
• Calculated formula: C37 H51 As I2 N2 O
• SMILES: [As]1(I)(I)N(C=C(C=[N]1c1c(cccc1C(C)C)C(C)C)c1ccccc1)c1c(cccc1C(C)C)C(C)C.O(CC)CC
• Title of publication: beta-Diiminato complexes of arsenic including the formally AsI compound [As3L3] [L = [N(C6H3Pri2-2,6)C(H)]2CPh].
• Authors of publication: Hitchcock, Peter B; Lappert, Michael F; Li, Gang; Protchenko, Andrey V
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 4
• Pages of publication: 428 - 429
• a: 11.2964 ± 0.0003 Å
• b: 24.718 ± 0.0004 Å
• c: 14.2829 ± 0.0004 Å
• α: 90°
• β: 97.267 ± 0.001°
• γ: 90°
• Cell volume: 3956.1 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No