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Information card for entry 7217854
Preview
Coordinates | 7217854.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C14 H16.25 Cl N3.25 O5.75 |
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Calculated formula | C14 H16.63 Cl N3.63 O5.37 |
Title of publication | Effect of inductive effect on the formation of cocrystals and eutectics |
Authors of publication | Prasad, Karothu Durga; Cherukuvada, Suryanarayan; Devaraj Stephen, L.; Guru Row, Tayur N. |
Journal of publication | CrystEngComm |
Year of publication | 2014 |
Journal volume | 16 |
Journal issue | 42 |
Pages of publication | 9930 |
a | 7.0625 ± 0.0009 Å |
b | 15.0679 ± 0.0019 Å |
c | 14.7835 ± 0.0014 Å |
α | 90° |
β | 90.563 ± 0.009° |
γ | 90° |
Cell volume | 1573.1 ± 0.3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0741 |
Residual factor for significantly intense reflections | 0.0554 |
Weighted residual factors for significantly intense reflections | 0.1351 |
Weighted residual factors for all reflections included in the refinement | 0.1457 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
180509 (current) | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/78. |
7217854.cif |
126378 | 2014-11-06 | cif/ Updating files of 7217852, 7217853, 7217854, 7217855 Original log message: Adding full bibliography for 7217852--7217855.cif. |
7217854.cif |
122695 | 2014-09-02 | cif/ Adding structures of 7217852, 7217853, 7217854, 7217855 via cif-deposit CGI script. |
7217854.cif |
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Users of the data should acknowledge the original authors of the
structural data.