Information card for entry 4304588

Structure parameters

• Chemical name: Bis(μ~2~-bis(bis(o-methoxyphenyl)phosphino)phenylamine) digold(I) trifluoromethanesulfonate dichloromethane solvate
• Formula: C72 H70 Au2 Cl4 F6 N2 O22 P4 S2
• Calculated formula: C72 H70 Au2 Cl4 F6 N2 O22 P4 S2
• SMILES: [Au]12[Au]([P](N([P]1(Oc1ccccc1OC)Oc1ccccc1OC)c1ccccc1)(Oc1ccccc1OC)Oc1ccccc1OC)[P](N([P]2(Oc1ccccc1OC)Oc1ccccc1OC)c1ccccc1)(Oc1ccccc1OC)Oc1ccccc1OC.FC(F)(S(=O)(=O)[O-])F.C(Cl)Cl.FC(F)(F)S(=O)(=O)[O-].C(Cl)Cl
• Title of publication: Bi-, Tetra-, and Hexanuclear AuI and Binuclear AgI Complexes and AgI Coordination Polymers Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Pyridyl Ligands
• Authors of publication: Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Joel T. Mague; Heikki M. Tuononen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 2764 - 2776
• a: 12.638 ± 0.002 Å
• b: 13.592 ± 0.002 Å
• c: 23.045 ± 0.004 Å
• α: 90°
• β: 99.108 ± 0.002°
• γ: 90°
• Cell volume: 3908.7 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• 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: 0.0404
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0831
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No