Information card for entry 2211734

Structure parameters

• Chemical name: Dichlorobis(1-methyl-1,4,5,6-tetrahydropyrimidine)palladium(II)
• Formula: C10 H20 Cl2 N4 Pd
• Calculated formula: C10 H20 Cl2 N4 Pd
• SMILES: C1=[N](CCCN1C)[Pd](Cl)([N]1=CN(CCC1)C)Cl
• Title of publication: Dichlorobis(1-methyl-1,4,5,6-tetrahydropyrimidine)palladium(II)
• Authors of publication: Chang, Chiung-Fang; Lee, Hon Man
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 1
• Pages of publication: m167 - m168
• a: 8.0324 ± 0.0002 Å
• b: 8.3664 ± 0.0002 Å
• c: 10.8658 ± 0.0003 Å
• α: 90°
• β: 104.008 ± 0.002°
• γ: 90°
• Cell volume: 708.49 ± 0.03 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0286
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.0544
• Weighted residual factors for all reflections included in the refinement: 0.0565
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes