Information card for entry 7017726

Structure parameters

• Formula: C10 H8 Cd N6 S2
• Calculated formula: C10 H8 Cd N6 S2
• Title of publication: New cadmium thio- and selenocyanato coordination compounds: structural snapshots on the reaction pathway to more condensed anionic networks.
• Authors of publication: Jess, Inke; Boeckmann, Jan; Näther, Christian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 1
• Pages of publication: 228 - 236
• a: 10.0015 ± 0.0006 Å
• b: 15.668 ± 0.0007 Å
• c: 8.6696 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1358.56 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c a
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.067
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.213
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No