Information card for entry 2201561

Structure parameters

• Formula: C6 H18 Cr O6 P3 S6
• Calculated formula: C6 H18 Cr O6 P3 S6
• SMILES: [Cr]123([S]=P(S1)(OC)OC)([S]=P(S2)(OC)OC)[S]=P(S3)(OC)OC
• Title of publication: Tris(<i>O,O</i>'-dimethyldithiophosphato)chromium(III)
• Authors of publication: Tetsuzo Ito
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 8
• Pages of publication: m449 - m450
• a: 14.28 ± 0.02 Å
• b: 11.17 ± 0.02 Å
• c: 12.98 ± 0.01 Å
• α: 90°
• β: 97.67 ± 0.09°
• γ: 90°
• Cell volume: 2052 ± 5 ų
• Cell temperature: 296 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections included in the refinement: 0.021
• Goodness-of-fit parameter for all reflections included in the refinement: 2.2
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes