Information card for entry 7117417

Structure parameters

• Common name: 3
• Chemical name: 3
• Formula: C19 H22 F6 N3 O P Pt
• Calculated formula: C19 H22 F6 N3 O P Pt
• SMILES: [Pt]1([n]2cccc(c2)CO)([n]2c(cccc2)c2[n]1cccc2)(C)(C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Platinum trimethyl bipyridyl thiolates ‒ new, tunable, red- to near IR emitting luminophores for bioimaging applications
• Authors of publication: Harriet L. Steel; Sarah L. Allinson; Jane Andre; Michael P. Coogan; James A. Platts
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 11441
• a: 9.141 ± 0.0004 Å
• b: 9.5731 ± 0.0004 Å
• c: 13.2139 ± 0.0006 Å
• α: 108.296 ± 0.004°
• β: 97.486 ± 0.004°
• γ: 95.712 ± 0.003°
• Cell volume: 1076.33 ± 0.09 ų
• Cell temperature: 99.98 ± 0.13 K
• Ambient diffraction temperature: 99.98 ± 0.13 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0227
• Residual factor for significantly intense reflections: 0.0211
• Weighted residual factors for significantly intense reflections: 0.0723
• Weighted residual factors for all reflections included in the refinement: 0.0755
• Goodness-of-fit parameter for all reflections included in the refinement: 0.673
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No