Information card for entry 7718969

Structure parameters

• Formula: C43.25 H34.25 Cd0.5 Ir N5.75 O5.75 S2
• Calculated formula: C41 H29 Cd0.5 Ir N5 O5 S2
• Title of publication: Coordination polymers with iridium(III) metalloligands: the effect of pore size upon luminescent cation sensing.
• Authors of publication: Hong, Zhejun; Siripanich, Pattara; Stansfield, Oliver G.; Hall, Christopher R.; Connell, Timothy U.; Hua, Carol
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 30
• Pages of publication: 11656 - 11666
• a: 37.02 ± 0.007 Å
• b: 10.917 ± 0.002 Å
• c: 18.882 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7631 ± 3 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0327
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0861
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No