Crystallography Open Database

Information card for entry 1502628

Preview

Coordinates	1502628.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H27 Cl2 N3 O S
Calculated formula	C24 H27 Cl2 N3 O S
Title of publication	Exploration of novel 2-alkylimino-1,3-thiazolines: T-type calcium channel inhibitory activity.
Authors of publication	Han, Minsoo; Nam, Kee Dal; Shin, Dongyun; Jeong, Nakcheol; Hahn, Hoh-Gyu
Journal of publication	Journal of combinatorial chemistry
Year of publication	2010
Journal volume	12
Journal issue	4
Pages of publication	518 - 530
a	22.27 ± 0.002 Å
b	11.0361 ± 0.0006 Å
c	19.418 ± 0.001 Å
α	90°
β	97.983 ± 0.002°
γ	90°
Cell volume	4726.2 ± 0.6 Å³
Cell temperature	299.1 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.041
Weighted residual factors for all reflections included in the refinement	0.119
Goodness-of-fit parameter for all reflections included in the refinement	1.101
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1502628.cif
91932	2013-12-28	cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs.	1502628.cif
35921	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 1502628 via cif-deposit CGI script.	1502628.cif