Information card for entry 7021616

Structure parameters

• Formula: C94 H83 Ag3 Cl4 N3 P6 S3
• Calculated formula: C94 H83 Ag3 Cl4 N3 P6 S3
• SMILES: c1(ccccc1)[P]1(c2ccccc2)N(c2ccc(cc2)SC)[P](c2ccccc2)(c2ccccc2)[Ag]23[P](c4ccccc4)(c4ccccc4)N(c4ccc(cc4)SC)[P](c4ccccc4)(c4ccccc4)[Ag]45[P](c6ccccc6)(c6ccccc6)N(c6ccc(cc6)SC)[P](c6ccccc6)(c6ccccc6)[Ag]1([Cl]24)[Cl]35.C(Cl)Cl
• Title of publication: Influence of a thioether function in short-bite diphosphine ligands on the nature of their silver complexes: structure of a trinuclear complex and of a coordination polymer.
• Authors of publication: Rosa, Vitor; Fliedel, Christophe; Ghisolfi, Alessio; Pattacini, Roberto; Avilés, Teresa; Braunstein, Pierre
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 34
• Pages of publication: 12109 - 12119
• a: 10.4426 ± 0.0002 Å
• b: 18.5138 ± 0.0004 Å
• c: 25.2621 ± 0.0005 Å
• α: 75.624 ± 0.001°
• β: 87.474 ± 0.001°
• γ: 87.744 ± 0.001°
• Cell volume: 4724.41 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0876
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1446
• Weighted residual factors for all reflections included in the refinement: 0.1586
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No