Information card for entry 7121071

Structure parameters

• Formula: C46 H47 N O
• Calculated formula: C46 H47 N O
• SMILES: O=C(Nc1c(cc(cc1C(c1ccccc1)c1ccccc1)C(C)C)C(c1ccccc1)c1ccccc1)C12CC3CC(C1)CC(C2)C3
• Title of publication: Kinetic stabilisation of a molecular strontium hydride complex using an extremely bulky amidinate ligand.
• Authors of publication: de Bruin-Dickason, Caspar N; Sutcliffe, Thomas; Alvarez Lamsfus, Carlos; Deacon, Glen B.; Maron, Laurent; Jones, Cameron
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 7
• Pages of publication: 786 - 789
• a: 8.5254 ± 0.0005 Å
• b: 25.7341 ± 0.0015 Å
• c: 16.0537 ± 0.0012 Å
• α: 90°
• β: 100.564 ± 0.002°
• γ: 90°
• Cell volume: 3462.4 ± 0.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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
• Residual factor for all reflections: 0.1258
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1313
• Weighted residual factors for all reflections included in the refinement: 0.1627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No