Information card for entry 4508640

Structure parameters

• Formula: C10 H8 Cl4 N2 Pt
• Calculated formula: C10 H8 Cl4 N2 Pt
• SMILES: [Pt]([n]1ccc(cc1)Cl)([n]1ccc(cc1)Cl)(Cl)Cl
• Title of publication: M−X···X‘−C Halogen-Bonded Network Formation in MX2(4-halopyridine)2Complexes (M = Pd, Pt; X = Cl, I; X‘ = Cl, Br, I)
• Authors of publication: Zordan, Fiorenzo; Brammer, Lee
• Journal of publication: Crystal Growth & Design
• Year of publication: 2006
• Journal volume: 6
• Journal issue: 6
• Pages of publication: 1374
• a: 5.3827 ± 0.0001 Å
• b: 6.9293 ± 0.0002 Å
• c: 9.4909 ± 0.0002 Å
• α: 75.219 ± 0.002°
• β: 83.95 ± 0.002°
• γ: 83.355 ± 0.002°
• Cell volume: 338.918 ± 0.014 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0659
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No