Information card for entry 7042579

Structure parameters

• Formula: C93 H81 Ag3 B Cl8 F4 N3 P6
• Calculated formula: C93 H81 Ag3 B Cl8 F4 N3 P6
• SMILES: c1(ccccc1)[P]1(c2ccccc2)N(c2ccccc2)[P](c2ccccc2)(c2ccccc2)[Ag]23[P](c4ccccc4)(c4ccccc4)N(c4ccccc4)[P](c4ccccc4)(c4ccccc4)[Ag]45[P](c6ccccc6)(c6ccccc6)N(c6ccccc6)[P](c6ccccc6)(c6ccccc6)[Ag]1([Cl]24)[Cl]35.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.[B](F)(F)(F)[F-]
• Title of publication: Mono- and polynuclear Ag(i) complexes of N-functionalized bis(diphenylphosphino)amine DPPA-type ligands: synthesis, solid-state structures and reactivity.
• Authors of publication: Ghisolfi, Alessio; Fliedel, Christophe; de Frémont, Pierre; Braunstein, Pierre
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 5571 - 5586
• a: 22.5824 ± 0.0007 Å
• b: 23.1008 ± 0.0007 Å
• c: 21.1189 ± 0.0007 Å
• α: 90°
• β: 116.239 ± 0.001°
• γ: 90°
• Cell volume: 9881.9 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• 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: 0.0903
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1305
• Weighted residual factors for all reflections included in the refinement: 0.1464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No