Information card for entry 8101868

Structure parameters

• Chemical name: bis(1-butyl-3-methylimidazolium)hexachlorotitanate(IV) bis(dichloromethane) solvate
• Formula: C18 H34 Cl10 N4 Ti
• Calculated formula: C18 H34 Cl10 N4 Ti
• Title of publication: Crystal structure of bis(1-butyl-3-methylimidazolium) hexachlorotitanate (IV) bis(dichloromethane) solvate, (C~8~H~15~N~2~)~2~[TiCl~6~] · 2CH~2~Cl~2~
• Authors of publication: Laus, G.; Bentivoglio, G.; Wurst, K.; Schottenberger, H.; Nauer, G.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2005
• Journal volume: 220
• Journal issue: 4
• Pages of publication: 577 - 578
• a: 12.8243 ± 0.0004 Å
• b: 9.2932 ± 0.0002 Å
• c: 14.3634 ± 0.0005 Å
• α: 90°
• β: 100.572 ± 0.002°
• γ: 90°
• Cell volume: 1682.75 ± 0.09 ų
• Cell temperature: 233 ± 2 K
• Ambient diffraction temperature: 233 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.05
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.1064
• Weighted residual factors for all reflections included in the refinement: 0.1122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No