Information card for entry 7120947

Structure parameters

• Formula: C29 H42 Cd N2
• Calculated formula: C29 H42 Cd N2
• SMILES: [CdH]1N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Carbodiimides as catalysts for the reduction of a cadmium hydride complex.
• Authors of publication: Webb, D. J.; Fitchett, C. M.; Lein, M.; Fulton, J. R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 460 - 462
• a: 12.5364 ± 0.0004 Å
• b: 15.9813 ± 0.0003 Å
• c: 14.0907 ± 0.0004 Å
• α: 90°
• β: 105.609 ± 0.003°
• γ: 90°
• Cell volume: 2718.93 ± 0.13 ų
• Cell temperature: 120.01 ± 0.1 K
• Ambient diffraction temperature: 120.01 ± 0.1 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: 0.0359
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0698
• Weighted residual factors for all reflections included in the refinement: 0.075
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No