Information card for entry 2234340

Structure parameters

• Chemical name: Bis{μ-2-[3-carboxylatomethyl-4-(phenylsulfanyl)phenyl]propanoato- κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''}bis[(2,2'-bipyridine- κ^2^<i>N</i>,<i>N</i>')cadmium]
• Formula: C54 H44 Cd2 N4 O8 S2
• Calculated formula: C54 H44 Cd2 N4 O8 S2
• Title of publication: Bis{μ-2-[3-carboxylatomethyl-4-(phenylsulfanyl)phenyl]propanoato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''}bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cadmium]
• Authors of publication: Li, Long; Ding, Yu-Qiu; Diao, Kai-Sheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m511
• a: 13.567 ± 0.003 Å
• b: 11.572 ± 0.003 Å
• c: 15.595 ± 0.004 Å
• α: 90°
• β: 92.54 ± 0.003°
• γ: 90°
• Cell volume: 2446 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0551
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0826
• Weighted residual factors for all reflections included in the refinement: 0.0897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes