Information card for entry 1547250

Structure parameters

• Formula: C28 H36 Br2 N4 O2
• Calculated formula: C28 H36 Br2 N4 O2
• SMILES: [Br-].[Br-].n1(c[n+](c2c1cccc2)Cc1ccccc1Cn1c2ccccc2[n+](c1)C(C)C)C(C)C.O.O
• Title of publication: Potential of silver against human colon cancer: (synthesis, characterization and crystal structures of xylyl (Ortho, meta, & Para) linked bis-benzimidazolium salts and Ag(I)-NHC complexes: In vitroanticancer studies)
• Authors of publication: Muhammad Adnan Iqbal; Rosenani A Haque; Siti Fatimah Nasri; AMS Abdul Majid; Mohamed B Khadeer Ahamed; Elham Farsi; Tabinda Fatima
• Journal of publication: Chemistry Central Journal
• Year of publication: 2013
• Journal volume: 7
• Pages of publication: 27
• a: 10.3809 ± 0.0002 Å
• b: 11.7017 ± 0.0003 Å
• c: 11.3918 ± 0.0002 Å
• α: 90°
• β: 91.742 ± 0.001°
• γ: 90°
• Cell volume: 1383.17 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0457
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0598
• Weighted residual factors for all reflections included in the refinement: 0.063
• Goodness-of-fit parameter for all reflections included in the refinement: 0.934
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No