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Information card for entry 4080168
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Coordinates | 4080168.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [Me3NN]Ni(CNAr)2 |
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Formula | C41 H47 N4 Ni |
Calculated formula | C41 H47 N4 Ni |
SMILES | [Ni]1([N](=C(C)C=C(N1c1c(cc(cc1C)C)C)C)c1c(cc(cc1C)C)C)(C#[N]c1c(cccc1C)C)C#[N]c1c(cccc1C)C |
Title of publication | β-Diketiminato Nickel Imides in Catalytic Nitrene Transfer to Isocyanides |
Authors of publication | Wiese, Stefan; Aguila, Mae Joanne B.; Kogut, Elzbieta; Warren, Timothy H. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 8 |
Pages of publication | 2300 |
a | 11.1873 ± 0.0016 Å |
b | 11.9314 ± 0.0017 Å |
c | 15.713 ± 0.002 Å |
α | 69.757 ± 0.002° |
β | 87.328 ± 0.002° |
γ | 65.752 ± 0.002° |
Cell volume | 1783 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0667 |
Residual factor for significantly intense reflections | 0.0434 |
Weighted residual factors for significantly intense reflections | 0.0943 |
Weighted residual factors for all reflections included in the refinement | 0.1046 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4080168.html
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Users of the data should acknowledge the original authors of the
structural data.