Information card for entry 7004252

Structure parameters

• Formula: C50 H54 Cl N5 Pd2
• Calculated formula: C50 H54 Cl N5 Pd2
• SMILES: [Pd]12(N(C(=CC(=[N]1c1ccccc1)C)C)c1ccccc1)[Cl][Pd]1(N(C(=CC(=[N]1c1ccccc1)C)C)c1ccccc1)[NH]2c1ccc(cc1)C(C)(C)C.c1ccccc1
• Title of publication: Novel dinuclear and trinuclear palladium β-diiminate complexes containing amido‒chloro double-bridges
• Authors of publication: Hadzovic, Alen; Janetzko, John; Song, Datong
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 25
• Pages of publication: 3279 - 3281
• a: 12.5418 ± 0.0004 Å
• b: 13.5019 ± 0.0004 Å
• c: 15.5413 ± 0.0005 Å
• α: 106.239 ± 0.0018°
• β: 105.947 ± 0.0018°
• γ: 97.1865 ± 0.0016°
• Cell volume: 2370.66 ± 0.14 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: 0.0812
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1533
• Weighted residual factors for all reflections included in the refinement: 0.1756
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No