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Information card for entry 1552985
Preview
Coordinates | 1552985.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H73 Br N2 O |
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Calculated formula | C46 H73 Br N2 O |
Title of publication | Singlet carbenes as mimics for transition metals: synthesis of an air stable organic mixed valence compound [M2(C2)+˙; M = cyclic(alkyl)(amino)carbene] |
Authors of publication | Jin, Liqun; Melaimi, Mohand; Liu, Liu; Bertrand, Guy |
Journal of publication | Org. Chem. Front. |
Year of publication | 2014 |
Journal volume | 1 |
Journal issue | 4 |
Pages of publication | 351 |
a | 9.3761 ± 0.0009 Å |
b | 13.3939 ± 0.0013 Å |
c | 16.9447 ± 0.0017 Å |
α | 90° |
β | 101.929 ± 0.002° |
γ | 90° |
Cell volume | 2082 ± 0.4 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
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 | 0.0886 |
Residual factor for significantly intense reflections | 0.0546 |
Weighted residual factors for significantly intense reflections | 0.1034 |
Weighted residual factors for all reflections included in the refinement | 0.1123 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1552985.html
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