Information card for entry 7011789

Structure parameters

• Formula: C38 H50 N4 Na2 O4
• Calculated formula: C38 H50 N4 Na2 O4
• SMILES: [Na]123([O](CC[O]1C)C)[N](c1ccc(cc1)C)=C[N]2(c1ccc(cc1)C)[Na]12([O](CC[O]1C)C)[N](c1ccc(cc1)C)=C[N]23c1ccc(cc1)C
• Title of publication: Synthesis and structural characterisation of some novel lithium and sodium N,N???-di(para-tolyl)formamidinate complexes
• Authors of publication: Cole, Marcus L.; Junk, Peter C.; Louis, Lance M.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 20
• Pages of publication: 3906
• a: 8.1389 ± 0.0016 Å
• b: 10.3 ± 0.002 Å
• c: 12.692 ± 0.003 Å
• α: 72.477 ± 0.004°
• β: 84.631 ± 0.003°
• γ: 71.255 ± 0.004°
• Cell volume: 960.8 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.086
• Residual factor for significantly intense reflections: 0.0699
• Weighted residual factors for significantly intense reflections: 0.1892
• Weighted residual factors for all reflections included in the refinement: 0.2121
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No