Crystallography Open Database

Information card for entry 1520649

1520648 << 1520649 >> 1520650

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Coordinates	1520649.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H32 O2 S3
Title of publication	New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.
Authors of publication	Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander
Journal of publication	Acta Chemica Scandinavica
Year of publication	1999
Journal volume	53
Pages of publication	133 - 140
a	8.8167 ± 0.0002 Å
b	10.8823 ± 0.0001 Å
c	26.5226 ± 0.0006 Å
α	90°
β	90.741 ± 0.001°
γ	90°
Cell volume	2544.52 ± 0.08 Å³
Ambient diffraction temperature	296 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0702
Weighted residual factors for significantly intense reflections	0.1544
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	No
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
188978 (current)	2016-12-06	cif/ (antanas@echidna.ibt.lt) Replacing dummy atoms with unknown values. This is the standard way of marking entries in the COD that do not contain atom coordinates.	1520649.cif
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.	1520649.cif
139551	2015-06-24	cif/ Adding structures of 1520649 via cif-deposit CGI script.	1520649.cif