Crystallography Open Database

Information card for entry 7154355

Preview

Coordinates	7154355.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H22 N4 O4
Calculated formula	C23 H22 N4 O4
Title of publication	Facile synthesis of spirooxindole-pyrazolines and spirobenzofuranone-pyrazolines and their fungicidal activity.
Authors of publication	Yang, Changjiang; Li, Juanjuan; Zhou, Rong; Chen, Xiangyu; Gao, Yunpeng; He, Zhengjie
Journal of publication	Organic & biomolecular chemistry
Year of publication	2015
Journal volume	13
Journal issue	17
Pages of publication	4869 - 4878
a	8.8803 ± 0.0018 Å
b	11.094 ± 0.002 Å
c	11.201 ± 0.002 Å
α	79.42 ± 0.03°
β	79.41 ± 0.03°
γ	77.65 ± 0.03°
Cell volume	1047.6 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0889
Residual factor for significantly intense reflections	0.0476
Weighted residual factors for significantly intense reflections	0.1089
Weighted residual factors for all reflections included in the refinement	0.127
Goodness-of-fit parameter for all reflections included in the refinement	0.997
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7154355.html