Information card for entry 4314766

Structure parameters

• Formula: C24 H27 As N2 O2
• Calculated formula: C24 H27 As N2 O2
• SMILES: [As]12(c3ccccc3)(N[C@H]([C@@H](c3ccccc3)[O]1)C)N[C@H]([C@@H](c1ccccc1)O2)C
• Title of publication: Do Spiroarsoranes Exhibit Polytopal Equilibrium in Solution?
• Authors of publication: Antonio R. Tapia-Benavides; Luis H. Mendoza-Huizar; Francisco Pérez-García; Hugo Tlahuext; Alejandro Alvarez; Margarita Tlahuextl
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 1496 - 1502
• a: 10.499 ± 0.002 Å
• b: 5.9685 ± 0.0012 Å
• c: 17.833 ± 0.004 Å
• α: 90°
• β: 90.79 ± 0.03°
• γ: 90°
• Cell volume: 1117.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for significantly intense reflections: 0.1305
• Weighted residual factors for all reflections included in the refinement: 0.1527
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No