Information card for entry 7703634

Structure parameters

• Formula: C25 H26 Au Cl3 N2
• Calculated formula: C25 H26 Au Cl3 N2
• SMILES: [Au](=C1C(=C2N(C(=CC=C2)C)C1(c1ccccc1)c1nc(ccc1)C)C(C)(C)C)(Cl)(Cl)Cl
• Title of publication: Allene-derived gold and platinum complexes: synthesis and first applications in catalysis.
• Authors of publication: Maliszewska, Hanna K.; Hughes, David L.; Muñoz, María Paz
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 13
• Pages of publication: 4034 - 4038
• a: 9.46335 ± 0.00014 Å
• b: 19.7083 ± 0.0002 Å
• c: 14.0613 ± 0.0002 Å
• α: 90°
• β: 108.285 ± 0.0015°
• γ: 90°
• Cell volume: 2490.11 ± 0.06 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0211
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0411
• Weighted residual factors for all reflections included in the refinement: 0.0418
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No