Information card for entry 2213963

Structure parameters

• Chemical name: Bis(2,3,5-triphenyltetrazolium) tetrachloridocadmate(II)
• Formula: C38 H30 Cd Cl4 N8
• Calculated formula: C38 H30 Cd Cl4 N8
• SMILES: [Cd](Cl)(Cl)([Cl-])[Cl-].n1n([n+](nc1c1ccccc1)c1ccccc1)c1ccccc1.n1n([n+](nc1c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Bis(2,3,5-triphenyltetrazolium) tetrachloridocadmate(II)
• Authors of publication: Shu-Fang Zhang; Xiao-Gang Yang; Zhi Liu; Wei-Hua Li; Bao-Rong Hou
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1583 - m1583
• a: 12.207 ± 0.002 Å
• b: 15.254 ± 0.003 Å
• c: 20.132 ± 0.004 Å
• α: 90°
• β: 90.73 ± 0.03°
• γ: 90°
• Cell volume: 3748.4 ± 1.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0252
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0531
• Weighted residual factors for all reflections included in the refinement: 0.0577
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes