Information card for entry 7230600

Structure parameters

• Formula: C48 H36 F3 N O5 P2 Pt S
• Calculated formula: C48 H36 F3 N O5 P2 Pt S
• Title of publication: Water-soluble cyclometalated platinum(ii) and iridium(iii) complexes: synthesis, tuning of the photophysical properties, and in vitro and in vivo phosphorescence lifetime imaging
• Authors of publication: Solomatina, Anastasia I.; Su, Shih-Hao; Lukina, Maria M.; Dudenkova, Varvara V.; Shcheslavskiy, Vladislav I.; Wu, Cheng-Ham; Chelushkin, Pavel S.; Chou, Pi-Tai; Koshevoy, Igor O.; Tunik, Sergey P.
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 31
• Pages of publication: 17224
• a: 12.1407 ± 0.0003 Å
• b: 12.2755 ± 0.0003 Å
• c: 14.8967 ± 0.0004 Å
• α: 101.793 ± 0.001°
• β: 99.306 ± 0.001°
• γ: 101.647 ± 0.001°
• Cell volume: 2080.25 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0292
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0693
• Weighted residual factors for all reflections included in the refinement: 0.0707
• 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: No