Information card for entry 4061686

Structure parameters

• Formula: C10 H17 Cl2 N Ti
• Calculated formula: C10 H17 Cl2 N Ti
• SMILES: [Ti]12345(Cl)(Cl)([N](CC[c]61[cH]2[cH]3[cH]4[cH]56)(C)C)C
• Title of publication: New Titanium Complexes Containing a Cyclopentadienyl Ligand with a Pendant Aminoalkyl Substituent: Preparation, Behavior of the Amino Group, and Catalytic Hydroamination of Alkynes
• Authors of publication: Esteruelas, M. A.; López, A. M. L.; Mateo, A. C.; Oñate, E.
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 8.8802 ± 0.0006 Å
• b: 9.1973 ± 0.0007 Å
• c: 15.0299 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1227.55 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No