Information card for entry 7153453

Structure parameters

• Formula: C38 H37 N3
• Calculated formula: C38 H37 N3
• SMILES: N1=C(C(C(c2cccc(c12)C)c1ccc(N(C)C)cc1)(c1ccccc1)c1ccccc1)c1ccc(N(C)C)cc1
• Title of publication: Domino reactions initiated by intramolecular hydride transfers from tri(di)arylmethane fragments to ketenimine and carbodiimide functions.
• Authors of publication: Alajarin, Mateo; Bonillo, Baltasar; Ortin, Maria-Mar; Sanchez-Andrada, Pilar; Vidal, Angel; Orenes, Raul-Angel
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2010
• Journal volume: 8
• Journal issue: 20
• Pages of publication: 4690 - 4700
• a: 8.6296 ± 0.0005 Å
• b: 11.381 ± 0.0007 Å
• c: 15.5193 ± 0.0009 Å
• α: 104.522 ± 0.002°
• β: 102.416 ± 0.002°
• γ: 96.09 ± 0.002°
• Cell volume: 1420.21 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0718
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1136
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No