Information card for entry 8101491

Structure parameters

• Formula: C8 H20 Cl N
• Calculated formula: C8 H20 Cl N
• SMILES: [Cl-].[N+](CC)(CC)(CC)CC
• Title of publication: Crystal structure of anhydrous tetraethylammonium chloride, [(CH3CH2)4N]Cl
• Authors of publication: Staples, Richard J.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 1999
• Journal volume: 214
• Journal issue: 2
• Pages of publication: 231 - 232
• a: 11.8207 ± 0.0002 Å
• b: 20.4092 ± 0.0004 Å
• c: 12.429 ± 0.0001 Å
• α: 90°
• β: 108.173 ± 0.003°
• γ: 90°
• Cell volume: 2848.94 ± 0.08 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.1159
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No