Information card for entry 7239861

Structure parameters

• Formula: C10.8 H7.2 Co0.4 N0.8 O3.2 S0.4
• Calculated formula: C10.8 H6.4 Co0.4 N0.8 O3.2 S0.4
• Title of publication: Assembly of four new cobalt coordination polymers modulated by N-coligands: sensitive and selective sensing of nitroaromatics, Fe3+ and Cr2O72− in water
• Authors of publication: Tu, Qian-Qian; Ren, Ling-Ling; Cui, Ying-Ying; Cheng, Ai-Ling; Gao, En-Qing
• Journal of publication: CrystEngComm
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 10
• Pages of publication: 1789 - 1801
• a: 7.4557 ± 0.0003 Å
• b: 12.6096 ± 0.0005 Å
• c: 13.7586 ± 0.0003 Å
• α: 94.478 ± 0.003°
• β: 98.662 ± 0.003°
• γ: 101.166 ± 0.003°
• Cell volume: 1246.84 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0534
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1213
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No