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Information card for entry 1552987
Preview
Coordinates | 1552987.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H70 N2 |
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Calculated formula | C46 H70 N2 |
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 | 9.5494 ± 0.0005 Å |
b | 12.1924 ± 0.0006 Å |
c | 17.6614 ± 0.0008 Å |
α | 86.558 ± 0.002° |
β | 84.548 ± 0.002° |
γ | 76.62 ± 0.002° |
Cell volume | 1989.92 ± 0.17 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0467 |
Residual factor for significantly intense reflections | 0.0369 |
Weighted residual factors for significantly intense reflections | 0.091 |
Weighted residual factors for all reflections included in the refinement | 0.0956 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1552987.html
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