Information card for entry 4061157

Structure parameters

• Formula: C54 H64 Cl2 O Si4 Zr
• Calculated formula: C54 H64 Cl2 O Si4 Zr
• SMILES: [Zr]12345678(Cl)(Cl)([c]9([Si](C)(C)c%10ccccc%10)[c]%101cccc[c]2%10[c]3([Si](C)(C)c1ccccc1)[cH]49)[c]1([Si](C)(C)c2ccccc2)[cH]5[c]6([Si](C)(C)c2ccccc2)[c]27[c]81cccc2.O(CC)CC
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 11.5765 ± 0.0006 Å
• b: 14.586 ± 0.0008 Å
• c: 15.452 ± 0.0008 Å
• α: 91.808 ± 0.001°
• β: 95.377 ± 0.001°
• γ: 96.695 ± 0.001°
• Cell volume: 2577.6 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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