Information card for entry 4335362

Structure parameters

• Formula: C28 H60 N6 O12 P2 Pd6
• Calculated formula: C28 H60 N6 O12 P2 Pd6
• SMILES: [Pd]134[N]2(C(C)C)P6(=O)[N]1(C(C)C)[Pd]17[N]6([Pd]26[O]=C(C)O[Pd]2([N]5([Pd]([N]8([Pd]([N]2(P58=O)C(C)C)([O]=C(C)O3)[O]4C)C(C)C)([O]=C(C)O1)[O]7C)C(C)C)[O]=C(C)O6)C(C)C
• Title of publication: Facile Formation of Stable Tris(imido)phosphate Trianions as Their Tri- and Hexanuclear Pd(II) Complexes in Protic Solvents
• Authors of publication: Arvind K. Gupta; S. Arun Dixith Reddy; Ramamoorthy Boomishankar
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 7608 - 7614
• a: 11.9132 ± 0.0006 Å
• b: 32.9964 ± 0.0014 Å
• c: 12.2459 ± 0.0005 Å
• α: 90°
• β: 115.837 ± 0.001°
• γ: 90°
• Cell volume: 4332.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0614
• Weighted residual factors for all reflections included in the refinement: 0.0672
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No