Information card for entry 7112598

Structure parameters

• Formula: C103 H109 Au2 Cl15 N4 O5 P2
• Calculated formula: C103 H107 Au2 Cl15 N4 O5 P2
• Title of publication: A stable Janus bis(maloNHC) and its zwitterionic coinage metal complexes
• Authors of publication: Daniela Tapu; Zachary McCarty; Colin McMillen
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 4725
• a: 11.131 ± 0.002 Å
• b: 24.888 ± 0.005 Å
• c: 21.128 ± 0.004 Å
• α: 90°
• β: 93.78 ± 0.03°
• γ: 90°
• Cell volume: 5840.3 ± 1.9 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 7
• 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: 0.0815
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1547
• Weighted residual factors for all reflections included in the refinement: 0.1847
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7112276
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No