Information card for entry 4348272

Structure parameters

• Formula: C26 H20 Au Cl N3 P
• Calculated formula: C26 H20 Au Cl N3 P
• SMILES: [Au](Cl)[P](c1ccccc1)(c1ccccc1)c1n(nnc1c1ccccc1)c1ccccc1
• Title of publication: Two Triazole-Based Phosphine Ligands Prepared via Temperature-Mediated Li/H Exchange: Cu(I) and Au(I) Complexes and Structural Studies.
• Authors of publication: Choubey, Bimba; Radhakrishna, Latchupatula; Mague, Joel T.; Balakrishna, Maravanji S.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 17
• Pages of publication: 8514 - 8526
• a: 10.3148 ± 0.0005 Å
• b: 10.384 ± 0.0005 Å
• c: 11.6306 ± 0.0006 Å
• α: 78.009 ± 0.002°
• β: 75.91 ± 0.002°
• γ: 76.813 ± 0.002°
• Cell volume: 1161.02 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0182
• Residual factor for significantly intense reflections: 0.0174
• Weighted residual factors for significantly intense reflections: 0.0415
• Weighted residual factors for all reflections included in the refinement: 0.0419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No