Information card for entry 7024086

Structure parameters

• Formula: C21 H48 Li N3 Zn
• Calculated formula: C21 H48 Li N3 Zn
• SMILES: [Li]1([N]2([C@@H](C)CCC[C@H]2C)[Zn](C(C)(C)C)C(C)(C)C)[N](C)(C)CC[N]1(C)C
• Title of publication: cis-2,6-Dimethylpiperidide: a structural mimic for TMP (2,2,6,6-tetramethylpiperidide) or DA (diisopropylamide)?
• Authors of publication: Campbell, Ross; Conway, Ben; Fairweather, Graham S.; García-Alvarez, Pablo; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.; O'Hara, Charles T; Robertson, Gemma M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 2
• Pages of publication: 511 - 519
• a: 8.399 ± 0.0003 Å
• b: 16.7308 ± 0.0004 Å
• c: 9.5282 ± 0.0004 Å
• α: 90°
• β: 108.761 ± 0.004°
• γ: 90°
• Cell volume: 1267.78 ± 0.08 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0298
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0504
• Weighted residual factors for all reflections included in the refinement: 0.0512
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No