Information card for entry 7059562

Structure parameters

• Formula: C56 H30 Ag Al B Cl6 F46 N2 O3 P
• Calculated formula: C56 H30 Ag Al B Cl6 F46 N2 O3 P
• SMILES: c1(ccccc1)[P](c1ccccc1)([BH2][N](C)(C)C)[Ag][N]#CC.C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(c1c(c(c(c(c1F)F)F)F)F)O[Al](OC1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)c1c(c(c(c(c1F)F)F)F)F)(OC1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)c1c(c(c(c(c1F)F)F)F)F)F.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl
• Title of publication: A new family of silver(i) complexes stabilised by the phosphanylborane (C6H5)2PBH2·N(CH3)3
• Authors of publication: Elsayed Moussa, Mehdi; Marquardt, Christian; Hegen, Oliver; Seidl, Michael; Scheer, Manfred
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 33
• Pages of publication: 14916 - 14919
• a: 11.3947 ± 0.0001 Å
• b: 19.7346 ± 0.0001 Å
• c: 31.3137 ± 0.0001 Å
• α: 90°
• β: 92.186 ± 0.001°
• γ: 90°
• Cell volume: 7036.38 ± 0.07 ų
• Cell temperature: 123.05 ± 0.1 K
• Ambient diffraction temperature: 123.05 ± 0.1 K
• Number of distinct elements: 10
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0897
• Weighted residual factors for all reflections included in the refinement: 0.0912
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No