Information card for entry 8105096

Structure parameters

• Formula: C12 H24 Cd N2 O4 P2 S4
• Calculated formula: C12 H24 Cd N2 O4 P2 S4
• Title of publication: Crystal structure of catena-[(μ2-pyrazine-κ2 N:N′)-bis(O,O′-di-ethyldithiophosphato-κ2 S,S′)cadmium(II)], {C12H24CdN2O4P2S4}n
• Authors of publication: Tan, Yee Seng; Tiekink, Edward R.T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 2
• Pages of publication: 319 - 321
• a: 11.7844 ± 0.0002 Å
• b: 7.6063 ± 0.0001 Å
• c: 13.1965 ± 0.0002 Å
• α: 90°
• β: 111.594 ± 0.002°
• γ: 90°
• Cell volume: 1099.86 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0173
• Residual factor for significantly intense reflections: 0.0171
• Weighted residual factors for significantly intense reflections: 0.0466
• Weighted residual factors for all reflections included in the refinement: 0.0467
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No