Information card for entry 4060682

Structure parameters

• Formula: C10 H20 Cl3 O2 Ta
• Calculated formula: C10 H20 Cl3 O2 Ta
• SMILES: [Ta]12(Cl)(Cl)(Cl)([O](C)CC[O]1C)C(=C2CC)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: 7.406 ± 0.002 Å
• b: 15.822 ± 0.003 Å
• c: 7.068 ± 0.001 Å
• α: 96.56 ± 0.02°
• β: 108.53 ± 0.02°
• γ: 78.7 ± 0.02°
• Cell volume: 768.7 ± 0.3 ų
• Cell temperature: 293.2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No