Information card for entry 7024926

Structure parameters

• Common name: Tetraethylammonium-1-cyanocarba-closo-dodecaborate
• Chemical name: Tetraethylammonium-1-cyanocarba-<i>closo</i>-dodecaborate
• Formula: C10 H31 B11 N2
• Calculated formula: C10 H31 B11 N2
• Title of publication: Salts of the 1-cyanocarba-closo-dodecaborate anions [1-NC-closo-1-CB11X11]- (X = H, F, Cl, Br, I).
• Authors of publication: Finze, Maik; Sprenger, Jan A. P.; Schaack, Bernd Bastian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 10
• Pages of publication: 2708 - 2716
• a: 9.0592 ± 0.0018 Å
• b: 10.065 ± 0.002 Å
• c: 10.736 ± 0.002 Å
• α: 90°
• β: 99.91 ± 0.03°
• γ: 90°
• Cell volume: 964.3 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1257
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.0904
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No