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Information card for entry 2240855
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Coordinates | 2240855.cif |
---|---|
Structure factors | 2240855.hkl |
Original IUCr paper | HTML |
Chemical name | <i>N</i>-[(Morpholin-4-yl)(thiophen-2-yl)methyl]benzamide |
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Formula | C16 H18 N2 O2 S |
Calculated formula | C16 H18 N2 O2 S |
Title of publication | Crystal structure of <i>N</i>-[(morpholin-4-yl)(thiophen-2-yl)methyl]benzamide |
Authors of publication | Prabhu, S. Arun; Suresh, M.; Jameel, A. Abdul; Padusha, M. Syed Ali; Gunasekaran, B. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2015 |
Journal volume | 71 |
Journal issue | 7 |
Pages of publication | o498 - o499 |
a | 16.5283 ± 0.0011 Å |
b | 9.9049 ± 0.0007 Å |
c | 9.6831 ± 0.0005 Å |
α | 90° |
β | 99.056 ± 0.002° |
γ | 90° |
Cell volume | 1565.47 ± 0.17 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0783 |
Residual factor for significantly intense reflections | 0.0542 |
Weighted residual factors for significantly intense reflections | 0.1617 |
Weighted residual factors for all reflections included in the refinement | 0.1818 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
181908 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/08 |
2240855.cif 2240855.hkl |
176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
2240855.cif 2240855.hkl |
139449 | 2015-06-20 | cif/ hkl/ Adding structures of 2240855 via cif-deposit CGI script. |
2240855.cif 2240855.hkl |
All data in the COD and the database itself are dedicated to the
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.
Users of the data should acknowledge the original authors of the
structural data.