Information card for entry 7006011

Structure parameters

• Common name: Silver-bis(4-((diphenylphosphanyl)-methyl)-benzene-1,2-diol)- triflate
• Chemical name: Silver-bis{4-[(diphenylphosphanyl)-methyl]-benzene-1,2-diol}-triflate
• Formula: C47 H50 Ag F3 O9 P2 S
• Calculated formula: C47 H50 Ag F3 O9 P2 S
• SMILES: [Ag]([P](Cc1cc(O)c(O)cc1)(c1ccccc1)c1ccccc1)([P](Cc1cc(O)c(O)cc1)(c1ccccc1)c1ccccc1)OS(=O)(=O)C(F)(F)F.O1CCCC1.O1CCCC1
• Title of publication: Boron templated catechol phosphines as bidentate ligands in silver complexes.
• Authors of publication: Chikkali, Samir H.; Gudat, Dietrich; Lissner, Falk; Nieger, Martin; Schleid, Thomas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 35
• Pages of publication: 3906 - 3913
• a: 14.3659 ± 0.0003 Å
• b: 16.1257 ± 0.0004 Å
• c: 19.8458 ± 0.0006 Å
• α: 90°
• β: 92.338 ± 0.001°
• γ: 90°
• Cell volume: 4593.7 ± 0.2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0705
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.0612
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No