Information card for entry 7008498

Structure parameters

• Common name: cis-Bis(N,N-diethyl-N'-benzoylthioureato)diiodoplatinum(IV)
• Chemical name: cis-Bis(N,N-diethyl-N'-benzoylthioureato)diiodoplatinum(IV)
• Formula: C24 H30 I2 N4 O2 Pt S2
• Calculated formula: C24 H30 I2 N4 O2 Pt S2
• SMILES: [Pt]12(I)(I)([S]=C(N=C(O1)c1ccccc1)N(CC)CC)[S]=C(N=C(O2)c1ccccc1)N(CC)CC
• Title of publication: Reactions of halogens with Pt(II) complexes of N-alkyl- and N,N-dialkyl-N'-benzoylthioureas: oxidative addition and formation of an I2 inclusion compound.
• Authors of publication: Westra, Arjan N.; Bourne, Susan A.; Esterhuysen, Catharine; Koch, Klaus R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 12
• Pages of publication: 2162 - 2172
• a: 8.8108 ± 0.0018 Å
• b: 10.92 ± 0.002 Å
• c: 16.228 ± 0.003 Å
• α: 74.23 ± 0.03°
• β: 78.5 ± 0.03°
• γ: 75.76 ± 0.03°
• Cell volume: 1441.7 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0564
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0553
• Weighted residual factors for all reflections included in the refinement: 0.0608
• Goodness-of-fit parameter for all reflections included in the refinement: 0.959
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No