Crystallography Open Database

Information card for entry 7157705

Preview

Coordinates	7157705.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H20 N2 O8 S
Calculated formula	C27 H20 N2 O8 S
Title of publication	Stereoselective synthesis of dispiro heterocycles by [3 + 2] cycloaddition of azomethine ylides with a thiazolo[3,2-<i>a</i>]indole derivative.
Authors of publication	Sathi, Vidya; Thomas, Noble V.; Deepthi, Ani
Journal of publication	Organic & biomolecular chemistry
Year of publication	2020
Journal volume	18
Journal issue	39
Pages of publication	7822 - 7826
a	7.6399 ± 0.0013 Å
b	11.119 ± 0.002 Å
c	15.958 ± 0.003 Å
α	70.281 ± 0.006°
β	78.966 ± 0.005°
γ	74.305 ± 0.005°
Cell volume	1221 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0653
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.0945
Weighted residual factors for all reflections included in the refinement	0.1107
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
258956 (current)	2020-11-06	cif/ Updating files of 7157705 Original log message: Adding full bibliography for 7157705.cif.	7157705.cif
256453	2020-09-16	cif/ Adding structures of 7157705 via cif-deposit CGI script.	7157705.cif