Information card for entry 4062744

Structure parameters

• Formula: C16 H20 Cl2 Zr
• Calculated formula: C16 H20 Cl2 Zr
• SMILES: [Zr]123456789(Cl)(Cl)[c]%10([c]1([cH]2[cH]4[c]3%10C)C)C(C)[c]15[c]6([cH]7[cH]8[c]91C)C
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 17.574 ± 0.0006 Å
• b: 8.8569 ± 0.0003 Å
• c: 20.521 ± 0.0006 Å
• α: 90°
• β: 91.407 ± 0.002°
• γ: 90°
• Cell volume: 3193.15 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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