Information card for entry 2241336

Structure parameters

• Chemical name: <i>cis</i>-Bis{4-phenyl-1-[(3<i>R</i>)-1,7,7-trimethyl-2-oxobicyclo[2.2.1]heptan-3-ylidene]thiosemicarbazidato-κ^3^<i>O</i>,<i>N</i>^1^,<i>S</i>}cadmium(II)
• Formula: C34 H40 Cd N6 O2 S2
• Calculated formula: C34 H40 Cd N6 O2 S2
• Title of publication: Crystal structure of <i>cis</i>-bis{4-phenyl-1-[(3<i>R</i>)-1,7,7-trimethyl-2-oxobicyclo[2.2.1]heptan-3-ylidene]thiosemicarbazidato-κ^3^<i>O</i>,<i>N</i>^1^,<i>S</i>}cadmium(II) with an unknown solvent molecule
• Authors of publication: Nogueira, Vanessa Senna; Bresolin, Leandro; Näther, Christian; Jess, Inke; de Oliveira, Adriano Bof
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 12
• Pages of publication: m234 - m235
• a: 10.3613 ± 0.0003 Å
• b: 12.3817 ± 0.0004 Å
• c: 16.5366 ± 0.0006 Å
• α: 68.727 ± 0.003°
• β: 72.094 ± 0.003°
• γ: 89.892 ± 0.003°
• Cell volume: 1866.74 ± 0.12 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 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: 0.0451
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.1031
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes