Crystallography Open Database

Information card for entry 7157171

Preview

Coordinates	7157171.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H21 Cl N O5
Calculated formula	C26 H21 Cl N O5
Title of publication	Thermal-mediated [1,3]-hydrogen transfer as the key step: access to oxindole-chromone hybrid collection with structural diversity
Authors of publication	Gong, Ying; Xu, Sheng-Wen; Liu, Xiong-Wei; Li, Zheng; Liu, Xiong-Li; Yao, Zhen; Zhou, Ying
Journal of publication	Organic & Biomolecular Chemistry
Year of publication	2019
a	9.1764 ± 0.0006 Å
b	10.3922 ± 0.0005 Å
c	11.8331 ± 0.0007 Å
α	92.396 ± 0.004°
β	100.32 ± 0.005°
γ	101.272 ± 0.005°
Cell volume	1085.31 ± 0.11 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 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	0.0666
Residual factor for significantly intense reflections	0.0599
Weighted residual factors for significantly intense reflections	0.1653
Weighted residual factors for all reflections included in the refinement	0.1747
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
219508 (current)	2019-10-25	cif/ Adding structures of 7157163, 7157164, 7157165, 7157166, 7157167, 7157168, 7157169, 7157170, 7157171 via cif-deposit CGI script.	7157171.cif