Information card for entry 2102622

Structure parameters

• Formula: C10 H14 Cl6 I2 N2 O2 Pt
• Calculated formula: C10 H14 Cl6 I2 N2 O2 Pt
• SMILES: [Pt](Cl)(Cl)(Cl)(Cl)([Cl-])[Cl-].[nH+]1cc(ccc1)I.[nH+]1cc(ccc1)I.O.O
• Title of publication: Water molecules insert into N—H···Cl—<i>M</i> hydrogen bonds while <i>M</i>—Cl···<i>X</i>—C halogen bonds remain intact in dihydrates of halopyridinium hexachloroplatinates
• Authors of publication: Zordan, Fiorenzo; Brammer, Lee
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 5
• Pages of publication: 512 - 519
• a: 7.395 ± 0.002 Å
• b: 11.002 ± 0.002 Å
• c: 13.727 ± 0.003 Å
• α: 97.453 ± 0.003°
• β: 95.101 ± 0.003°
• γ: 103.968 ± 0.003°
• Cell volume: 1066.2 ± 0.4 ų
• Cell temperature: 150 ± 5 K
• Ambient diffraction temperature: 150 ± 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: 0.0744
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1821
• Weighted residual factors for all reflections included in the refinement: 0.1935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No