Information card for entry 7028740

Structure parameters

• Formula: C22 H18 Au Cl N3 P
• Calculated formula: C22 H18 Au Cl N3 P
• SMILES: [Au](Cl)[P](Nc1nccc(n1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Gold(i) complexes with heteroaryl phosphine ligands.
• Authors of publication: Sarcher, Christian; Farsadpour, Saeid; Taghizadeh Ghoochany, Leila; Sun, Yu; Thiel, Werner R.; Roesky, Peter W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 6
• Pages of publication: 2397 - 2405
• a: 8.801 ± 0.0004 Å
• b: 11.0375 ± 0.0004 Å
• c: 11.7633 ± 0.0005 Å
• α: 74.503 ± 0.003°
• β: 71.796 ± 0.003°
• γ: 77.52 ± 0.003°
• Cell volume: 1035.01 ± 0.08 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0253
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0605
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No