Information card for entry 8102113

Structure parameters

• Chemical name: bis(η^5^-cyclopentadienyl)-pyrrolide-titanium(III)
• Formula: C24 H34 N Ti
• Calculated formula: C24 H34 N Ti
• Title of publication: Crystal structure of bis(η^5^-cyclopentadienyl)-pyrrolide-titanium (III), Ti(C~10~H~15~)~2~(C~4~H~4~N)
• Authors of publication: Spannenberg, Anke; Burlakov, Vladimir V.; Arndt, Perdita; Klahn, Marcus; Rosenthal, Uwe
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2007
• Journal volume: 222
• Journal issue: 3
• Pages of publication: 192 - 194
• a: 10.864 ± 0.002 Å
• b: 14.281 ± 0.003 Å
• c: 27.535 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4272 ± 1.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.0979
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 0.833
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No