Information card for entry 4306652

Structure parameters

• Formula: C24 H21 Cl2 N O2 Pt S
• Calculated formula: C24 H21 Cl2 N O2 Pt S
• SMILES: [Pt](Cl)(Cl)([S](=O)(C)C)[n]1c(\C=C/C(=O)c2c3ccccc3cc3ccccc23)cccc1
• Title of publication: Synthesis, Crystal Structure, Studies in Solution and Cytotoxicity of Two New Fluorescent Platinum(II) Compounds Containing Anthracene Derivatives as a Carrier Ligand
• Authors of publication: Patricia Marqués-Gallego; Hans den Dulk; Jaap Brouwer; Huub Kooijman; Anthony L. Spek; Olivier Roubeau; Simon J. Teat; Jan Reedijk
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11171 - 11179
• a: 17.0002 ± 0.001 Å
• b: 15.2874 ± 0.0009 Å
• c: 8.7615 ± 0.0006 Å
• α: 90°
• β: 93.193 ± 0.001°
• γ: 90°
• Cell volume: 2273.5 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0636
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.0893
• Weighted residual factors for all reflections included in the refinement: 0.0981
• Goodness-of-fit parameter for all reflections included in the refinement: 0.922
• Diffraction radiation wavelength: 0.7848 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No