Information card for entry 7113881

Structure parameters

• Formula: C29 H42 N2 O Ti
• Calculated formula: C32 H51 N2 O Ti
• Title of publication: Facile resolution of constrained geometry indenyl-phenoxide ligationElectronic supplementary information (ESI) available: synthesis of compounds 1‒8 and ORTEP views of4,5 and 6. See http://www.rsc.org/suppdata/cc/b2/b212724e/
• Authors of publication: Turner, Luke E.; Thorn, Matthew G.; Fanwick, Phillip E.; Rothwell, Ian P.
• Journal of publication: Chemical Communications
• Year of publication: 2003
• Journal issue: 9
• Pages of publication: 1034
• a: 10.0202 ± 0.0002 Å
• b: 13.0802 ± 0.0003 Å
• c: 22.0926 ± 0.0004 Å
• α: 90°
• β: 102.311 ± 0.0013°
• γ: 90°
• Cell volume: 2829.01 ± 0.1 ų
• Cell temperature: 209 K
• Ambient diffraction temperature: 209 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for all reflections included in the refinement: 0.16
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No