Information card for entry 7013050

Structure parameters

• Common name: [Na(DCCAMPTMS)(DME)2]
• Formula: C30 H57 N4 Na O4 Si
• Calculated formula: C30 H57 N4 Na O4 Si
• SMILES: [Si](N(C(=N\C1CCCCC1)\N1[Na]34([n]5n(cccc15)C)([O](C)CC[O]3C)[O](CC[O]4C)C)C1CCCCC1)(C)(C)C
• Title of publication: Pyridyl donor induced 1,3-silyl migration in metal complexes of the guanidine CyHNC{N(SiMe3)Py}NCy, Py = 2-(6-MeC5H3N)
• Authors of publication: Cole, Marcus L.; Junk, Peter C.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 11
• Pages of publication: 2109
• a: 10.943 ± 0.002 Å
• b: 12.892 ± 0.003 Å
• c: 12.249 ± 0.002 Å
• α: 90°
• β: 91.84 ± 0.03°
• γ: 90°
• Cell volume: 1727.2 ± 0.6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1371
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.1219
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No