Information card for entry 7029937

Structure parameters

• Formula: C12 H16 Cl4 N4 O6 Pt
• Calculated formula: C12 H16 Cl4 N4 O6 Pt
• SMILES: c1(cc(ccc1)N(=O)=O)[NH2][Pt](Cl)(Cl)([NH2]c1cc(ccc1)N(=O)=O)(Cl)Cl.O.O
• Title of publication: Reactions of platinum(IV)-bound nitriles with isomeric nitroanilines: addition vs. substitution.
• Authors of publication: Chernyshev, Alexander N.; Bokach, Nadezhda A.; Gushchin, Pavel V.; Haukka, Matti; Kukushkin, Vadim Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 41
• Pages of publication: 12857 - 12864
• a: 5.8898 ± 0.0002 Å
• b: 18.3306 ± 0.0007 Å
• c: 8.9748 ± 0.0003 Å
• α: 90°
• β: 98.354 ± 0.001°
• γ: 90°
• Cell volume: 958.67 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0325
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0543
• Weighted residual factors for all reflections included in the refinement: 0.0556
• Goodness-of-fit parameter for all reflections included in the refinement: 1.294
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No