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Information card for entry 7715431
Preview
Coordinates | 7715431.cif |
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Original paper (by DOI) | HTML |
Formula | C68 H26 B2 F20 N4 |
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Calculated formula | C68 H26 B2 F20 N4 |
Title of publication | Direct C-H electrophilic borylation with (C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>B-NTf<sub>2</sub> to generate B-N dibenzo[<i>a</i>,<i>h</i>]pyrenes. |
Authors of publication | Nguyen, Tony; Dutton, Jason L.; Chang, Chia Yun; Zhou, Wen; Piers, Warren E. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2024 |
Journal volume | 53 |
Journal issue | 17 |
Pages of publication | 7273 - 7281 |
a | 10.2642 ± 0.0005 Å |
b | 10.8711 ± 0.0006 Å |
c | 12.859 ± 0.0007 Å |
α | 71.888 ± 0.004° |
β | 78.885 ± 0.004° |
γ | 84.992 ± 0.004° |
Cell volume | 1337.59 ± 0.13 Å3 |
Cell temperature | 296.15 K |
Ambient diffraction temperature | 296.15 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 | 0.1072 |
Residual factor for significantly intense reflections | 0.061 |
Weighted residual factors for significantly intense reflections | 0.144 |
Weighted residual factors for all reflections included in the refinement | 0.1717 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.996 |
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/7715431.html
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