Information card for entry 2242291

Structure parameters

• Chemical name: Bis(μ-<i>N</i>,<i>N</i>-diallyldithiocarbamato)bis[(<i>N</i>,<i>N</i>-diallyldithiocarbamato)cadmium]
• Formula: C28 H40 Cd2 N4 S8
• Calculated formula: C28 H40 Cd2 N4 S8
• SMILES: [Cd]123([S]=C([S]1[Cd]14([S]=C([S]21)N(CC=C)CC=C)[S]=C(S4)N(CC=C)CC=C)N(CC=C)CC=C)[S]=C(S3)N(CC=C)CC=C
• Title of publication: Bis(μ-<i>N</i>,<i>N</i>-diallyldithiocarbamato)bis[(<i>N</i>,<i>N</i>-diallyldithiocarbamato)cadmium]
• Authors of publication: Onwudiwe, Damian C.; Hrubaru, Madalina; Hosten, Eric C.; Arderne, Charmaine
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 9
• Pages of publication: 1353 - 1356
• a: 8.0872 ± 0.0002 Å
• b: 9.4146 ± 0.0002 Å
• c: 13.0721 ± 0.0003 Å
• α: 75.858 ± 0.001°
• β: 78.46 ± 0.001°
• γ: 77.488 ± 0.001°
• Cell volume: 930.75 ± 0.04 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0168
• Residual factor for significantly intense reflections: 0.015
• Weighted residual factors for significantly intense reflections: 0.0356
• Weighted residual factors for all reflections included in the refinement: 0.0371
• Goodness-of-fit parameter for all reflections included in the refinement: 1.152
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes