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Information card for entry 7240843
Preview
Coordinates | 7240843.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 1,10-phenantroline-4,7-dichloro-2,9-diylbis(piperidin-1-yl-methanone) |
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Formula | C24 H26 Cl2 N4 O3 |
Calculated formula | C24 H24 Cl2 N4 O3 |
SMILES | Clc1cc(nc2c1ccc1c(Cl)cc(nc21)C(=O)N1CCCCC1)C(=O)N1CCCCC1.O |
Title of publication | The impact of alicyclic substituents on the extraction ability of new family of 1,10-phenanthroline-2,9-diamides |
Authors of publication | Lemport, Pavel S.; Matveev, Petr I.; Yatsenko, Alexander V.; Evsiunina, Mariia V.; Petrov, Valentine S.; Tarasevich, Boris N.; Roznyatovsky, Vitaly A.; Dorovatovskii, Pavel V.; Khrustalev, Victor N.; Zhokhov, Sergey S.; Solov'ev, Vitaly P.; Aslanov, Leonid A.; Petrov, Vladimir G.; Kalmykov, Stepan N.; Nenajdenko, Valentine G.; Ustyniuk, Yuri A. |
Journal of publication | RSC Advances |
Year of publication | 2020 |
Journal volume | 10 |
Journal issue | 44 |
Pages of publication | 26022 - 26033 |
a | 36.3267 ± 0.0015 Å |
b | 6.8415 ± 0.0002 Å |
c | 22.188 ± 0.0011 Å |
α | 90° |
β | 122.928 ± 0.003° |
γ | 90° |
Cell volume | 4628.5 ± 0.4 Å3 |
Cell temperature | 292 ± 2 K |
Ambient diffraction temperature | 292 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0992 |
Residual factor for significantly intense reflections | 0.0362 |
Weighted residual factors for significantly intense reflections | 0.0591 |
Weighted residual factors for all reflections included in the refinement | 0.0721 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.846 |
Diffraction radiation wavelength | 1.54186 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
257978 (current) | 2020-10-06 | cif/ Updating files of 7240841, 7240842, 7240843, 7240844 Original log message: Adding full bibliography for 7240841--7240844.cif. |
7240843.cif |
254199 | 2020-07-11 | cif/ Adding structures of 7240841, 7240842, 7240843, 7240844 via cif-deposit CGI script. |
7240843.cif |
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Users of the data should acknowledge the original authors of the
structural data.