Information card for entry 7019056

Structure parameters

• Formula: C19 H13 Cl4 I N2
• Calculated formula: C19 H13 Cl4 I N2
• SMILES: [I-].Clc1c(Cl)c(Cl)c(Cl)c2[n+](cn(c12)Cc1ccc2c(cccc2)c1)C
• Title of publication: Synthesis, characterization, and antimicrobial activity of silver carbene complexes derived from 4,5,6,7-tetrachlorobenzimidazole against antibiotic resistant bacteria.
• Authors of publication: Wright, Brian D.; Shah, Parth N.; McDonald, Lucas J.; Shaeffer, Michael L.; Wagers, Patrick O.; Panzner, Matthew J.; Smolen, Justin; Tagaev, Jasur; Tessier, Claire A.; Cannon, Carolyn L.; Youngs, Wiley J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 21
• Pages of publication: 6500 - 6506
• a: 24.5 ± 0.003 Å
• b: 12.9443 ± 0.0012 Å
• c: 14.1288 ± 0.0013 Å
• α: 90°
• β: 117.003 ± 0.002°
• γ: 90°
• Cell volume: 3992.3 ± 0.7 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: 0.0404
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0798
• Weighted residual factors for all reflections included in the refinement: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No