Information card for entry 4060824

Structure parameters

• Common name: Cp*2Zr(o-C6F4H)H
• Formula: C26 H32 F4 Zr
• Calculated formula: C26 H32 F4 Zr
• SMILES: [ZrH]12345678(c9c(F)c(F)c(F)c(F)c9)([c]9([c]4([c]3([c]2([c]19C)C)C)C)C)[c]1([c]5([c]6([c]7([c]81C)C)C)C)C
• Journal of publication: Organometallics
• Year of publication: 2002
• a: 10.0929 ± 0.0007 Å
• b: 21.6773 ± 0.0014 Å
• c: 10.9753 ± 0.0007 Å
• α: 90°
• β: 92.867 ± 0.001°
• γ: 90°
• Cell volume: 2398.2 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• 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