Information card for entry 7021782

Structure parameters

• Common name: 1b
• Formula: C21 H28 Cl N O2 Pt S
• Calculated formula: C21 H28 Cl N O2 Pt S
• SMILES: [Pt]1([N](=Cc2c(O1)cccc2)c1c(cccc1C(C)C)C(C)C)(Cl)[S](=O)(C)C
• Title of publication: Synthesis, structural characterization and cis-trans isomerization of novel (salicylaldiminato)platinum(ii) complexes.
• Authors of publication: Zheng, Feng; Hutton, Alan T.; van Sittert, Cornelia G. C. E.; Moss, John R.; Mapolie, Selwyn F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 31
• Pages of publication: 11163 - 11179
• a: 16.4013 ± 0.0018 Å
• b: 19.269 ± 0.002 Å
• c: 14.4597 ± 0.0016 Å
• α: 90°
• β: 91.062 ± 0.002°
• γ: 90°
• Cell volume: 4569 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0397
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.046
• Weighted residual factors for all reflections included in the refinement: 0.0504
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No