Information card for entry 2003280

Structure parameters

• Formula: C16 H13 Co N3 O4 S3
• Calculated formula: C15.3333 H13.3333 Co N3 O3.33333 S3
• Title of publication: <i>fac</i>-[Co(C~5~H~4~NOS)~3~].H~2~O. 1/2CH~3~OH and <i>fac</i>-[Co(C~5~H~4~NOS)~3~]. 1/3CH~3~OH
• Authors of publication: Xu, Y.-J.; Kang, B.-S.; Chen, X.-T.; Huang, L.-R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 3
• Pages of publication: 370 - 374
• a: 21.997 ± 0.011 Å
• b: 9.094 ± 0.005 Å
• c: 27.594 ± 0.009 Å
• α: 90°
• β: 95.87 ± 0.04°
• γ: 90°
• Cell volume: 5491 ± 4 ų
• Cell temperature: 296 ± 1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.062
• Goodness-of-fit parameter for significantly intense reflections: 1.38
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No