Information card for entry 7026582

Structure parameters

• Formula: C21 H39 Li N2 O
• Calculated formula: C21 H39 Li N2 O
• SMILES: O(c1c(cc(cc1C(C)(C)C)C)C(C)(C)C)[Li]1[N](C)(C)CC[N]1(C)C
• Title of publication: Structural diversity in polyamine Lewis base stabilised lithium aryloxides.
• Authors of publication: Cousins, David M.; Davidson, Matthew G.; García-Vivó, Daniel; Mahon, Mary F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 35
• Pages of publication: 8203 - 8209
• a: 18.113 ± 0.0011 Å
• b: 13.609 ± 0.0006 Å
• c: 28.582 ± 0.0017 Å
• α: 90°
• β: 103.924 ± 0.002°
• γ: 90°
• Cell volume: 6838.4 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.2313
• Residual factor for significantly intense reflections: 0.0929
• Weighted residual factors for significantly intense reflections: 0.2135
• Weighted residual factors for all reflections included in the refinement: 0.2974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No