Information card for entry 4060403

Structure parameters

• Formula: C24 H27 N O Zr
• Calculated formula: C24 H27 N O Zr
• SMILES: [Zr]123456789(N([C@H]%10[C@H]%11O[C@H](c%12c%11cccc%12)[C@@H]1%10)C(C)(C)C)([cH]1[cH]2[cH]3[cH]4[cH]51)[cH]1[cH]6[cH]7[cH]8[cH]91.[Zr]123456789(N([C@@H]%10[C@@H]%11O[C@@H](c%12c%11cccc%12)[C@H]1%10)C(C)(C)C)([cH]1[cH]2[cH]3[cH]4[cH]51)[cH]1[cH]6[cH]7[cH]8[cH]91
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 12.459 ± 0.004 Å
• b: 12.6 ± 0.004 Å
• c: 13.982 ± 0.005 Å
• α: 81.834 ± 0.007°
• β: 65.711 ± 0.006°
• γ: 86.004 ± 0.007°
• Cell volume: 1980.2 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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