Information card for entry 7019630

Structure parameters

• Formula: C60 H66 Ag2 Cl8 N4 O10 P4
• Calculated formula: C60 H66 Ag2 Cl8 N4 O10 P4
• SMILES: C1N2CC[N+](=C2)C[P](c2ccccc2)(c2ccccc2)[Ag]23[Cl][Ag]([P]1(c1ccccc1)c1ccccc1)([P](CN1CC[N+](C[P]2(c2ccccc2)c2ccccc2)=C1)(c1ccccc1)c1ccccc1)[Cl]3.[O-]Cl(=O)(=O)=O.O.C(Cl)Cl.[O-]Cl(=O)(=O)=O.O.C(Cl)Cl
• Title of publication: Formation of N-heterocyclic diphosphine ligands from Ag(i)-assisted condensation reactions between bdppeda and formaldehyde and their binuclear silver(i) complexes.
• Authors of publication: Sun, Sha; Ren, Zhi-Gang; Yang, Ju-Hua; He, Run-Tian; Wang, Fan; Wu, Xin-Yi; Gong, Wei-Jie; Li, Hong-Xi; Lang, Jian-Ping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 27
• Pages of publication: 8447 - 8454
• a: 13.601 ± 0.003 Å
• b: 14.615 ± 0.003 Å
• c: 17.145 ± 0.003 Å
• α: 90°
• β: 90.03 ± 0.03°
• γ: 90°
• Cell volume: 3408.1 ± 1.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0857
• Residual factor for significantly intense reflections: 0.0745
• Weighted residual factors for significantly intense reflections: 0.1512
• Weighted residual factors for all reflections included in the refinement: 0.1569
• Goodness-of-fit parameter for all reflections included in the refinement: 1.218
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No