Crystallography Open Database

Information card for entry 7159116

Preview

Coordinates	7159116.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H15 F N2 S
Calculated formula	C24 H15 F N2 S
Title of publication	Visible/solar-light-driven thiyl-radical-triggered synthesis of multi-substituted pyridines.
Authors of publication	Sahoo, Ashish Kumar; Rakshit, Amitava; Pan, Avishek; Dhara, Hirendra Nath; Patel, Bhisma K.
Journal of publication	Organic & biomolecular chemistry
Year of publication	2023
Journal volume	21
Journal issue	8
Pages of publication	1680 - 1691
a	13.2258 ± 0.0005 Å
b	8.0745 ± 0.0003 Å
c	19.2139 ± 0.0008 Å
α	90°
β	109.317 ± 0.001°
γ	90°
Cell volume	1936.37 ± 0.13 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 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	0.0601
Residual factor for significantly intense reflections	0.0407
Weighted residual factors for significantly intense reflections	0.0973
Weighted residual factors for all reflections included in the refinement	0.1182
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
281559 (current)	2023-03-04	cif/ Updating files of 7159116 Original log message: Adding full bibliography for 7159116.cif.	7159116.cif
280571	2023-01-25	cif/ Adding structures of 7159116 via cif-deposit CGI script.	7159116.cif