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Information card for entry 4038601
Preview
Coordinates | 4038601.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C12 H14 B Cl3 N4 O2 S |
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Calculated formula | C12 H14 B Cl3 N4 O2 S |
Title of publication | <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. |
Authors of publication | Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2020 |
a | 8.303 ± 0.002 Å |
b | 9.935 ± 0.003 Å |
c | 21.623 ± 0.006 Å |
α | 90° |
β | 97.49 ± 0.004° |
γ | 90° |
Cell volume | 1768.5 ± 0.8 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 7 |
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 | 0.1146 |
Residual factor for significantly intense reflections | 0.0575 |
Weighted residual factors for significantly intense reflections | 0.1461 |
Weighted residual factors for all reflections included in the refinement | 0.1744 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4038601.html
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