Information card for entry 1512783

Structure parameters

• Formula: C39 H45 Ag N4 O1.5
• Calculated formula: C39 H45.0012 Ag N4 O1.5
• SMILES: [Ag](=C1N(Cc2ccccc2)c2c(N1CCCC)cccc2)=C1N(c2ccccc2N1Cc1ccccc1)CCCC.O=C(C)C.O
• Title of publication: Non-symmetrically substituted N-heterocyclic carbene-Ag(I) complexes of benzimidazol-2-ylidenes: Synthesis, crystal structures, anticancer activity and transmetallation studies
• Authors of publication: Rosenani A. Haque; Mohammed Z. Ghdhayeb; Srinivasa Budagumpi; Abbas Washeel Salman; Mohamed B. Khadeer Ahamed; Amin Malik Shah Abdul Majid
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 394
• Pages of publication: 519 - 525
• a: 12.3083 ± 0.0004 Å
• b: 13.0893 ± 0.0005 Å
• c: 13.5459 ± 0.0004 Å
• α: 115.974 ± 0.002°
• β: 102.26 ± 0.002°
• γ: 103.788 ± 0.002°
• Cell volume: 1775.58 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0679
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1673
• Weighted residual factors for all reflections included in the refinement: 0.1771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No