Information card for entry 4348252

Structure parameters

• Formula: C26 H20 Au Cl N3 P
• Calculated formula: C26 H20 Au Cl N3 P
• SMILES: [Au](Cl)[P](c1ccccc1)(c1ccccc1)c1ccccc1n1nnc(c1)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: 9.559 ± 0.0005 Å
• b: 9.9126 ± 0.0007 Å
• c: 13.401 ± 0.0007 Å
• α: 99.547 ± 0.002°
• β: 95.713 ± 0.002°
• γ: 112.439 ± 0.001°
• Cell volume: 1138.79 ± 0.12 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: 0.0196
• Residual factor for significantly intense reflections: 0.0182
• Weighted residual factors for significantly intense reflections: 0.0454
• Weighted residual factors for all reflections included in the refinement: 0.0459
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No