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Information card for entry 7234994
Preview
Coordinates | 7234994.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H36 K N O4 |
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Calculated formula | C31 H36 K N O4 |
Title of publication | The structural diversity of heterocycle-fused potassium cyclopentadienides |
Authors of publication | Nifant'ev, Ilya E.; Vinogradov, Alexander A.; Minyaev, Mikhail E.; Komarov, Pavel D.; Lyssenko, Konstantin A.; Birin, Kirill P.; Dyadchenko, Viktor P.; Ivchenko, Pavel V. |
Journal of publication | RSC Advances |
Year of publication | 2019 |
Journal volume | 9 |
Journal issue | 50 |
Pages of publication | 29195 |
a | 9.4637 ± 0.0012 Å |
b | 11.0911 ± 0.0015 Å |
c | 13.9898 ± 0.0017 Å |
α | 74.333 ± 0.003° |
β | 89.812 ± 0.003° |
γ | 81.725 ± 0.003° |
Cell volume | 1398.2 ± 0.3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0888 |
Residual factor for significantly intense reflections | 0.0576 |
Weighted residual factors for significantly intense reflections | 0.1361 |
Weighted residual factors for all reflections included in the refinement | 0.1567 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7234994.html
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Users of the data should acknowledge the original authors of the
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