Information card for entry 7033141

Structure parameters

• Formula: C27 H29 Au2 Cl2 N2 P
• Calculated formula: C27 H29 Au2 Cl2 N2 P
• SMILES: [Au](P([Au]Cl)(=C1N(C=CN1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)c1ccccc1)Cl
• Title of publication: Copper(i), silver(i) and gold(i) complexes of N-heterocyclic carbene-phosphinidene.
• Authors of publication: Adiraju, Venkata A. K.; Yousufuddin, Muhammed; Rasika Dias, H. V.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 10
• Pages of publication: 4449 - 4454
• a: 14.2115 ± 0.0011 Å
• b: 11.7065 ± 0.0009 Å
• c: 16.6136 ± 0.0013 Å
• α: 90°
• β: 98.04 ± 0.0019°
• γ: 90°
• Cell volume: 2736.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0506
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0838
• Weighted residual factors for all reflections included in the refinement: 0.0905
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No