Information card for entry 7017723

Structure parameters

• Formula: C14 H8 Cd3 N10 S6
• Calculated formula: C14 H8 Cd3 N10 S6
• 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: 6.9128 ± 0.0004 Å
• b: 9.2461 ± 0.0006 Å
• c: 10.6609 ± 0.0007 Å
• α: 108.162 ± 0.005°
• β: 91.352 ± 0.005°
• γ: 103.857 ± 0.005°
• Cell volume: 625.04 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0228
• Residual factor for significantly intense reflections: 0.019
• Weighted residual factors for significantly intense reflections: 0.0416
• Weighted residual factors for all reflections included in the refinement: 0.0426
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No