Information card for entry 4063019

Structure parameters

• Formula: C25 H32 N P Ti
• Calculated formula: C25 H32 N P Ti
• SMILES: [Ti]123456789%10(N=P(c%11c([c]%128[cH]7[cH]6[cH]5[cH]%10[cH]9%12)cccc%11)(C(C)(C)C)C(C)(C)C)[cH]5[cH]1[cH]2[cH]3[cH]45
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 9.37 ± 0.005 Å
• b: 20.591 ± 0.012 Å
• c: 12.046 ± 0.007 Å
• α: 90°
• β: 100.181 ± 0.011°
• γ: 90°
• Cell volume: 2288 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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