Information card for entry 7101006

Structure parameters

• Formula: C55 H46 Cl2 N O2 Ta
• Calculated formula: C55 H46 Cl2 N O2 Ta
• SMILES: [Ta]1(Cl)(Cl)(Oc2c(cccc2c2ccccc2)c2ccccc2)(Oc2c(cccc2c2ccccc2)c2ccccc2)[n]2c(cccc2)C1C.c1ccccc1.c1ccccc1
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 11.4442 ± 0.0004 Å
• b: 11.7997 ± 0.0004 Å
• c: 17.5214 ± 0.0005 Å
• α: 82.0975 ± 0.0019°
• β: 84.3171 ± 0.0018°
• γ: 75.1193 ± 0.0017°
• Cell volume: 2259.97 ± 0.13 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• 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