Information card for entry 7042018

Structure parameters

• Formula: C54 H70 Ag2 F12 N10 P2
• Calculated formula: C54 H70 Ag2 F12 N10 P2
• SMILES: [Ag](=C1N(CN2C(=[Ag]3)N(CC2)c2c(cc(cc2C)C)C)CCN1c1c(cc(cc1C)C)C)=C1N(CN2C=3N(CC2)c2c(cc(cc2C)C)C)CCN1c1c(cc(cc1C)C)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].N#CC.N#CC
• Title of publication: Chelated bis(NHC) complexes of saturated (imidazolin-2-ylidene) NHC ligands: structural authentication and facile ligand fragmentation.
• Authors of publication: Gardiner, Michael G.; McGuinness, David S.; Vanston, Catriona R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 9
• Pages of publication: 3051 - 3058
• a: 13.015 ± 0.002 Å
• b: 13.237 ± 0.001 Å
• c: 19.112 ± 0.002 Å
• α: 74.1 ± 0.01°
• β: 83.16 ± 0.01°
• γ: 68.73 ± 0.01°
• Cell volume: 2950.2 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.0698
• Weighted residual factors for significantly intense reflections: 0.1944
• Weighted residual factors for all reflections included in the refinement: 0.2104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No