Information card for entry 4060684

Structure parameters

• Formula: C16 H20 Cl3 N2 Ta
• Calculated formula: C16 H20 Cl3 N2 Ta
• SMILES: [Ta]1(Cl)(Cl)(Cl)([n]2ccccc2)([n]2ccccc2)C(=C1CC)CC
• Title of publication: Preparation, Structural Characterization, and Reactions of Tantalum-Alkyne Complexes
• Authors of publication: Toshiyuki Oshiki
• Journal of publication: Organometallics
• Year of publication: 2003
• a: 14.406 ± 0.003 Å
• b: 8.881 ± 0.002 Å
• c: 16.33 ± 0.002 Å
• α: 90°
• β: 114.62 ± 0.01°
• γ: 90°
• Cell volume: 1899.2 ± 0.8 ų
• Cell temperature: 293.2 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No