Information card for entry 7709206

Structure parameters

• Chemical name: Complex of Cu(I) chloride with bis(2-pyridyl)phenylarsine
• Formula: C16 H13 As Br Cu N2
• Calculated formula: C16 H13 As Br Cu N2
• Title of publication: Pyridylarsine-based Cu(I) complexes showing TADF mixed with fast phosphorescence: a speeding-up emission rate using arsine ligands.
• Authors of publication: Artem'ev, Alexander V.; Demyanov, Yan V.; Rakhmanova, Marianna I.; Bagryanskaya, Irina Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• a: 9.22 ± 0.003 Å
• b: 11.284 ± 0.004 Å
• c: 16.043 ± 0.005 Å
• α: 90°
• β: 96.547 ± 0.013°
• γ: 90°
• Cell volume: 1658.2 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0467
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0833
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No