Information card for entry 2230882

Structure parameters

• Chemical name: Poly[[(1,10-phenanthroline){μ~3~-2,2',2''-[1,3,5-triazine-2,4,6- triyltris(sulfanediyl)]triacetato}cadmium] 0.42-hydrate]
• Formula: C21 H15.84 Cd N5 O6.42 S3
• Calculated formula: C21 H15.842 Cd N5 O6.421 S3
• Title of publication: Poly[[(1,10-phenanthroline){μ~3~-2,2',2''-[1,3,5-triazine-2,4,6-triyltris(sulfanediyl)]triacetato}cadmium] 0.42-hydrate]
• Authors of publication: Chi, Chun-Jing; Peng, Yan-Qiang; Zeng, Su-Yuan; Sun, De-Zhi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 7
• Pages of publication: m826 - m827
• a: 10.618 ± 0.002 Å
• b: 10.987 ± 0.002 Å
• c: 12.601 ± 0.002 Å
• α: 95.815 ± 0.003°
• β: 114.197 ± 0.002°
• γ: 113.909 ± 0.002°
• Cell volume: 1161.1 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0412
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0656
• Weighted residual factors for all reflections included in the refinement: 0.0707
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes