Information card for entry 4062895

Structure parameters

• Formula: C18 H22 F2 Zr
• Calculated formula: C18 H22 F2 Zr
• SMILES: [cH]12[cH]3[c]45CCCC[c]64[cH]1[Zr]14782356([cH]2[c]38[c]7([cH]4[cH]12)CCCC3)(F)F
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 7.002 ± 0.001 Å
• b: 18.91 ± 0.004 Å
• c: 11.667 ± 0.002 Å
• α: 90°
• β: 96.12 ± 0.03°
• γ: 90°
• Cell volume: 1536 ± 0.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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