Information card for entry 4316477

Structure parameters

• Formula: C16 H13 Au Cl N2 P
• Calculated formula: C16 H13 Au Cl N2 P
• SMILES: [Au](Cl)[P](c1ccccn1)(c1ccccn1)c1ccccc1
• Title of publication: Heteropolynuclear Gold Complexes with Metallophilic Interactions: Modulation of the Luminescent Properties
• Authors of publication: Maria José Calhorda; Carmen Ceamanos; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Carmen Larraz; Pedro D. Vaz; M. Dolores Villacampa
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 8255 - 8269
• a: 7.993 ± 0.0006 Å
• b: 11.0534 ± 0.0008 Å
• c: 17.7914 ± 0.0013 Å
• α: 90°
• β: 99.094 ± 0.001°
• γ: 90°
• Cell volume: 1552.1 ± 0.2 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: 0.0249
• Residual factor for significantly intense reflections: 0.0234
• Weighted residual factors for significantly intense reflections: 0.0585
• Weighted residual factors for all reflections included in the refinement: 0.0591
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No