Information card for entry 4338912

Structure parameters

• Common name: [(Et2O)3Na][(CO)5WPNb(N[Np]Ar)3]
• Formula: C56 H90 N3 Na Nb O8 P W
• Calculated formula: C56 H90 N3 Na Nb O8 P W
• SMILES: N(c1cc(C)cc(c1)C)(CC(C)(C)C)[Nb](N(c1cc(cc(c1)C)C)CC(C)(C)C)(N(c1cc(C)cc(c1)C)CC(C)(C)C)#[P][W](C#[O])(C#[O])(C#[O])(C#[O])C#[O][Na]([O](CC)CC)([O](CC)CC)[O](CC)CC
• Title of publication: Ethylenebis(triphenylphosphine)platinum as a probe for niobium-mediated diphosphorus chemistry.
• Authors of publication: Piro, Nicholas A.; Cummins, Christopher C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 18
• Pages of publication: 7387 - 7393
• a: 18.1028 ± 0.0007 Å
• b: 20.7179 ± 0.0008 Å
• c: 16.985 ± 0.0007 Å
• α: 90°
• β: 98.788 ± 0.001°
• γ: 90°
• Cell volume: 6295.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0771
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No