Information card for entry 4338178

Structure parameters

• Formula: C84 H81 Ag3 Au Cl4 N3 O16 P8
• Calculated formula: C84 H81 Ag3 Au Cl4 N3 O16 P8
• SMILES: c1(ccccc1)[P]1(c2ccccc2)C[P]23C[P](c4ccccc4)(c4ccccc4)[Ag][P](c4ccccc4)(c4ccccc4)C[P]([Au]3)(C[P](c3ccccc3)(c3ccccc3)[Ag][P](c3ccccc3)(c3ccccc3)C2)C[P](c2ccccc2)(c2ccccc2)[Ag]1.C(#N)C.C(#N)C.C(#N)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: Coinage metal complexes supported by the tri- and tetraphosphine ligands.
• Authors of publication: Dau, Minh Thuy; Shakirova, Julia R.; Karttunen, Antti J.; Grachova, Elena V.; Tunik, Sergey P.; Melnikov, Alexey S.; Pakkanen, Tapani A.; Koshevoy, Igor O.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 9
• Pages of publication: 4705 - 4715
• a: 31.4363 ± 0.0008 Å
• b: 15.7649 ± 0.0004 Å
• c: 18.7672 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9300.8 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 8
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1066
• Weighted residual factors for all reflections included in the refinement: 0.1126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No