Information card for entry 7042015

Structure parameters

• Formula: C18 H16 Au Cl N P
• Calculated formula: C18 H16 Au Cl N P
• SMILES: [Au](Cl)[P](c1nc(C)ccc1)(c1ccccc1)c1ccccc1
• Title of publication: Highly efficient cold-white light emission in a [Au2CuCl2(P∩N)2]PF6 type salt.
• Authors of publication: Hobbollahi, Elnaz; List, Manuela; Hupp, Benjamin; Mohr, Fabian; Berger, Raphael J. F.; Steffen, Andreas; Monkowius, Uwe
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 11
• Pages of publication: 3438 - 3442
• a: 11.438 ± 0.003 Å
• b: 12.047 ± 0.003 Å
• c: 12.858 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1771.7 ± 0.8 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 0.933
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No