Information card for entry 1540431

Structure parameters

• Formula: C72 H74 As N4
• Calculated formula: C72 H74 As N4
• Title of publication: Zwitterionic and biradicaloid heteroatomic cyclopentane derivatives containing different group 15 elements
• Authors of publication: Hinz, Alexander; Schulz, Axel; Villinger, Alexander
• Journal of publication: Chem. Sci.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 1
• Pages of publication: 745
• a: 10.8398 ± 0.0018 Å
• b: 16.34 ± 0.003 Å
• c: 17.69 ± 0.003 Å
• α: 85.439 ± 0.006°
• β: 75.15 ± 0.005°
• γ: 82.111 ± 0.006°
• Cell volume: 2996.8 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1623
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1122
• Weighted residual factors for all reflections included in the refinement: 0.147
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No