Information card for entry 2215876

Structure parameters

• Chemical name: (±)-Di-μ-chlorido-[μ-<i>N</i>,<i>N</i>'-{[3,3'-methylenebis(2,4,6-trimethyl- 3,1-phenylene)]dimethylene}bis(2-methylpropan-2- amine)]bis[chloridopalladium(II)]
• Formula: C29 H46 Cl4 N2 Pd2
• Calculated formula: C29 H46 Cl4 N2 Pd2
• SMILES: C1c2c(cc(c(c2C)Cc2c(cc(c(c2C)C[NH](C(C)(C)C)[Pd]2([Cl][Pd](Cl)([Cl]2)[NH]1C(C)(C)C)Cl)C)C)C)C
• Title of publication: (±)-Di-μ-chlorido-(μ-<i>N</i>,<i>N</i>'-{[3,3'-methylenebis(2,4,6-trimethyl-3,1-phenylene)]dimethylene}bis(2-methylpropan-2-amine))bis[chloridopalladium(II)]
• Authors of publication: Chahen, Ludovic; Therrien, Bruno; Süss-Fink, Georg
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2687 - m2687
• a: 18.7173 ± 0.0011 Å
• b: 14.7968 ± 0.0008 Å
• c: 23.1967 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6424.5 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0575
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1054
• Goodness-of-fit parameter for all reflections included in the refinement: 0.922
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes