Information card for entry 7042577

Structure parameters

• Formula: C62 H54 Ag B F4 N2 P4 S2
• Calculated formula: C62 H54 Ag B F4 N2 P4 S2
• SMILES: c1(ccccc1)[P]1(c2ccccc2)N(c2ccc(cc2)SC)[P](c2ccccc2)(c2ccccc2)[Ag]21[P](c1ccccc1)(c1ccccc1)N(c1ccc(cc1)SC)[P]2(c1ccccc1)c1ccccc1.[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: 11.947 ± 0.0002 Å
• b: 11.947 ± 0.0002 Å
• c: 41.0063 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5852.86 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 78
• Hermann-Mauguin space group symbol: P 43
• Hall space group symbol: P 4cw
• Residual factor for all reflections: 0.1258
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.125
• Weighted residual factors for all reflections included in the refinement: 0.1688
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No