Information card for entry 2205956

Structure parameters

• Chemical name: Benzimidazolium bis(1H-benzimidazole-κN^3^)chloro(oxydiacetato-κ^3^O,O',O'')cadium(II)
• Formula: C25 H23 Cd Cl N6 O5
• Calculated formula: C25 H23 Cd Cl N6 O5
• SMILES: [Cd]12(Cl)([n]3c[nH]c4ccccc34)([n]3c[nH]c4ccccc34)OC(=O)C[O]1CC(=O)O2.[nH]1c[nH+]c2ccccc12
• Title of publication: Benzimidazolium bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)chloro(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')cadmium(II)
• Authors of publication: Gaduo; Jian-Rong Su; Duan-Jun Xu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 6
• Pages of publication: m1231 - m1233
• a: 9.016 ± 0.002 Å
• b: 11.1672 ± 0.0014 Å
• c: 13.243 ± 0.003 Å
• α: 78.47 ± 0.01°
• β: 80.58 ± 0.03°
• γ: 84.82 ± 0.01°
• Cell volume: 1286.5 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.024
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.052
• Weighted residual factors for all reflections included in the refinement: 0.053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No