Information card for entry 7010273

Structure parameters

• Chemical name: Chlorodimethylsulfoxide(N,N-diethyl-N'-benzoylthioureato)platinum(II)
• Formula: C14 H21 Cl N2 O2 Pt S2
• Calculated formula: C14 H21 Cl N2 O2 Pt S2
• SMILES: [Pt]1([S]=C(N=C(O1)c1ccccc1)N(CC)CC)(Cl)[S](=O)(C)C
• Title of publication: Synthesis, characterisation and coordination chemistry of novel chiral N,N-dialkyl-N '-menthyloxycarbonylthioureas. Crystal and molecular structures of N,N-diethyl-N '-(−)-(3R)-menthyloxycarbonylthiourea and cis-(S,S)-[Pt(L)Cl(DMSO)] [where HL = N-(+)-(3R)-menthyloxycarbonyl-N'-morpholinothiourea or N-benzoyl-N',N'-diethylthiourea]
• Authors of publication: Sacht, Cheryl; Datt, Michael S.; Otto, Stefanus; Roodt, Andreas
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 24
• Pages of publication: 4579
• a: 8.7436 ± 0.0004 Å
• b: 10.0717 ± 0.0005 Å
• c: 11.5723 ± 0.0006 Å
• α: 76.263 ± 0.001°
• β: 89.207 ± 0.001°
• γ: 68.205 ± 0.001°
• Cell volume: 916.05 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0343
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0725
• Weighted residual factors for all reflections included in the refinement: 0.0751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No