Information card for entry 2006586

Structure parameters

• Common name: titanium exo-isodicyclopentadienide trichloride
• Chemical name: (η^5^-exo-tricyclo[5.2.1.0^2,6^]deca-2,5-dien-3-yl) trichlorotitanium
• Formula: C10 H11 Cl3 Ti
• Calculated formula: C10 H11 Cl3 Ti
• Title of publication: <i>endo</i> and <i>exo</i> Isomers of Isodicyclopentadienyltrichlorotitanium
• Authors of publication: Gallucci, Judith C.; Kozmina, Natasha; Paquette, Leo A.; Zaegel, Florence; Meunier, Philippe; Gautheron, Bernard
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 10
• Pages of publication: 1416 - 1420
• a: 12.4368 ± 0.0008 Å
• b: 9.062 ± 0.0001 Å
• c: 10.3153 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1162.56 ± 0.13 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for all reflections included in the refinement: 0.023
• Goodness-of-fit parameter for significantly intense reflections: 1.7
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No