Crystallography Open Database

Information card for entry 7239974

Preview

Coordinates	7239974.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H15 Cl N2 O
Calculated formula	C16 H15 Cl N2 O
Title of publication	Ammonium hydroxide as the ultimate amino source for the synthesis of N-unprotected 3-tetrasubstituted aminooxindoles via catalyst-free direct amination
Authors of publication	Yue, Jing; Ma, Xi-Tao; Liu, Xiong-Li; Wang, Jun-Xin; Liu, Xiong-Wei; Zhou, Ying
Journal of publication	Green Chemistry
Year of publication	2020
Journal volume	22
Journal issue	6
Pages of publication	1837 - 1841
a	12.8233 ± 0.0013 Å
b	10.2114 ± 0.0007 Å
c	12.0326 ± 0.0013 Å
α	90°
β	116.906 ± 0.013°
γ	90°
Cell volume	1405 ± 0.3 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 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	0.0562
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.0944
Weighted residual factors for all reflections included in the refinement	0.1027
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation probe	x-ray
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
257597 (current)	2020-10-06	cif/ Updating files of 7239973, 7239974 Original log message: Adding full bibliography for 7239973--7239974.cif.	7239974.cif
250328	2020-04-05	cif/ Updating files of 7239973, 7239974 Original log message: Adding full bibliography for 7239973--7239974.cif.	7239974.cif
248431	2020-02-25	cif/ Adding structures of 7239973, 7239974 via cif-deposit CGI script.	7239974.cif