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Information card for entry 1547170
Preview
Coordinates | 1547170.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H34 |
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Calculated formula | C42 H34 |
SMILES | c12ccc3c(c4c(c3c1ccc1c(c3c(c21)cccc3)c1c(cc(cc1C)C)C)cccc4)c1c(cc(cc1C)C)C |
Title of publication | Synthesis and Properties of Quinoidal Fluorenofluorenes. |
Authors of publication | Barker, Joshua E.; Frederickson, Conerd K.; Jones, Michael H.; Zakharov, Lev N.; Haley, Michael M. |
Journal of publication | Organic letters |
Year of publication | 2017 |
Journal volume | 19 |
Journal issue | 19 |
Pages of publication | 5312 - 5315 |
a | 7.1561 ± 0.0006 Å |
b | 8.0619 ± 0.0006 Å |
c | 12.865 ± 0.001 Å |
α | 87.837 ± 0.004° |
β | 88.161 ± 0.004° |
γ | 75.494 ± 0.004° |
Cell volume | 717.84 ± 0.1 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 2 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0677 |
Residual factor for significantly intense reflections | 0.0621 |
Weighted residual factors for significantly intense reflections | 0.1733 |
Weighted residual factors for all reflections included in the refinement | 0.1778 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1547170.html
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