Information card for entry 4511030

Structure parameters

• Common name: PtCl2(ATQACH2NH2)
• Formula: C10 H18 Cl2 N2 Pt
• Calculated formula: C10 H18 Cl2 N2 Pt
• SMILES: [Pt]1(Cl)(Cl)[N]23C4(CC[C@@H]2CC[C@@H]3CC4)C[NH2]1
• Title of publication: Crystal Packing in Planar Platinum(II) and Palladium(II) Complexes. Hydrogen-Bond-Mediated Supramolecular Assembly of Ten Wedge-Shaped Molecules into a Cyclic Array
• Authors of publication: Gussenhoven, Emily M.; Jevric, Martyn; Olmstead, Marilyn M.; Fettinger, James C.; Mascal, Mark; Balch, Alan L.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2009
• Journal volume: 9
• Journal issue: 4
• Pages of publication: 1786
• a: 19.524 ± 0.003 Å
• b: 7.5482 ± 0.0012 Å
• c: 7.9651 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1173.8 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.0655
• Weighted residual factors for all reflections included in the refinement: 0.0687
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No