Information card for entry 1515705

Structure parameters

• Formula: C62 H54 Ag2 N4 O4
• Calculated formula: C62 H54 Ag2 N4 O4
• SMILES: [Ag]([Ag](OC(=O)C)=C1N(C(=C(N1Cc1ccccc1)c1ccccc1)c1ccccc1)Cc1ccccc1)(OC(=O)C)=C1N(Cc2ccccc2)C(c2ccccc2)=C(N1Cc1ccccc1)c1ccccc1
• Title of publication: Novel benzyl-substituted N-heterocyclic carbene-silver acetate complexes: synthesis, cytotoxicity and antibacterial studies.
• Authors of publication: Patil, Siddappa; Deally, Anthony; Gleeson, Brendan; Müller-Bunz, Helge; Paradisi, Francesca; Tacke, Matthias
• Journal of publication: Metallomics : integrated biometal science
• Year of publication: 2011
• Journal volume: 3
• Journal issue: 1
• Pages of publication: 74 - 88
• a: 23.9368 ± 0.0007 Å
• b: 9.5997 ± 0.0002 Å
• c: 25.2845 ± 0.0007 Å
• α: 90°
• β: 119.297 ± 0.004°
• γ: 90°
• Cell volume: 5066.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0273
• Residual factor for significantly intense reflections: 0.0233
• Weighted residual factors for significantly intense reflections: 0.0551
• Weighted residual factors for all reflections included in the refinement: 0.0564
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No