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Information card for entry 4086768
Preview
Coordinates | 4086768.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H48 Co N5 O2 |
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Calculated formula | C31 H48 Co N5 O2 |
SMILES | [O]#C[Co](=C1N(C=CN1C1CCCCC1)C1CCCCC1)(=C1N(C2CCCCC2)C=CN1C1CCCCC1)N=O |
Title of publication | Correction to Synthesis and Thermal Properties of Novel NHC-Stabilized Cobalt Carbonyl Nitrosyl Complexes |
Authors of publication | Hering, Florian; Berthel, Johannes H. J.; Lubitz, Katharina; Paul, Ursula S. D.; Härterich, Heidi Schneider Marcel; Radius, Udo |
Journal of publication | Organometallics |
Year of publication | 2016 |
a | 13.8677 ± 0.0006 Å |
b | 15.4412 ± 0.0007 Å |
c | 15.8969 ± 0.0007 Å |
α | 90° |
β | 110.16 ± 0.002° |
γ | 90° |
Cell volume | 3195.5 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0667 |
Residual factor for significantly intense reflections | 0.0406 |
Weighted residual factors for significantly intense reflections | 0.0911 |
Weighted residual factors for all reflections included in the refinement | 0.102 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
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/4086768.html
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Users of the data should acknowledge the original authors of the
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