Information card for entry 7126048

Structure parameters

• Formula: C57 H76 As Cl8 Ga2 N3
• Calculated formula: C57 H76 As Cl8 Ga2 N3
• Title of publication: Isolation of singlet carbene derived 2-arsa-1,3-butadiene radical cations and dications.
• Authors of publication: Sharma, Mahendra K.; Blomeyer, Sebastian; Neumann, Beate; Stammler, Hans-Georg; Hinz, Alexander; van Gastel, Maurice; Ghadwal, Rajendra S.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 24
• Pages of publication: 3575 - 3578
• a: 13.7117 ± 0.0005 Å
• b: 24.2939 ± 0.0007 Å
• c: 24.861 ± 0.0008 Å
• α: 100.452 ± 0.002°
• β: 98.045 ± 0.003°
• γ: 98.408 ± 0.003°
• Cell volume: 7937.7 ± 0.5 ų
• Cell temperature: 100.01 ± 0.12 K
• Ambient diffraction temperature: 100.01 ± 0.12 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0829
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1177
• Weighted residual factors for all reflections included in the refinement: 0.1308
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No