Information card for entry 7102800

Structure parameters

• Formula: C20 H48 N3 Na Zn
• Calculated formula: C20 H48 N3 Na Zn
• SMILES: [Zn]([N]([Na]2[N](C)(C)CC[N]2(C)C)(C(C)C)C(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Transamination chemistry of sodium TMP-zincate: synthesis and crystal structure of a chiral amidozincate
• Authors of publication: Armstrong, David R.; Clegg, William; Dale, Sophie H.; García-Álvarez, Joaquín; Harrington, Ross W.; Hevia, Eva; Honeyman, Gordon W.; Kennedy, Alan R.; Mulvey, Robert E.; O'Hara, Charles T.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2008
• Journal issue: 2
• Pages of publication: 187 - 189
• a: 27.7184 ± 0.001 Å
• b: 9.8386 ± 0.0003 Å
• c: 19.6286 ± 0.0007 Å
• α: 90°
• β: 102.215 ± 0.002°
• γ: 90°
• Cell volume: 5231.7 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1029
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.0794
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No