Information card for entry 7042002

Structure parameters

• Chemical name: Tris(1,2-dimethoxyethane)lithium bis(pyrazine-5,6-dicarbonitrile-2,3-diolato)borate
• Formula: C24 H30 B Li N8 O10
• Calculated formula: C24 H30 B Li N8 O10
• Title of publication: New lithium borates with bistetrazolato(2-) and pyrazinediolato(2-) ligands - potentially interesting lithium electrolyte additives.
• Authors of publication: Finger, Lars H.; Venker, Alexander; Schröder, Fabian G; Sundermeyer, Jörg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 9
• Pages of publication: 3014 - 3024
• a: 18.906 ± 0.0011 Å
• b: 15.4153 ± 0.0009 Å
• c: 21.5073 ± 0.0013 Å
• α: 90°
• β: 96.314 ± 0.002°
• γ: 90°
• Cell volume: 6230.1 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0646
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.0926
• Weighted residual factors for all reflections included in the refinement: 0.1031
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No