Crystallography Open Database

Information card for entry 7249837

Preview

Coordinates	7249837.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H24 N2 O4
Calculated formula	C21 H24 N2 O4
Title of publication	Innovative aminoglutethimide co-crystals: synthesis, characterization, and insights into molecular interactions
Authors of publication	Qi, Ying; Liu, Yang; Li, Xia; Xu, Juan; Zhang, Qi
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	8
Pages of publication	1146 - 1156
a	16.904 ± 0.005 Å
b	6.4769 ± 0.0017 Å
c	17.825 ± 0.005 Å
α	90°
β	101.367 ± 0.008°
γ	90°
Cell volume	1913.3 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1333
Residual factor for significantly intense reflections	0.0835
Weighted residual factors for significantly intense reflections	0.2188
Weighted residual factors for all reflections included in the refinement	0.2499
Goodness-of-fit parameter for all reflections included in the refinement	1.07
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
298179 (current)	2025-03-04	cif/ Updating files of 7249835, 7249836, 7249837 Original log message: Adding full bibliography for 7249835--7249837.cif.	7249837.cif
297464	2025-01-25	cif/ Adding structures of 7249835, 7249836, 7249837 via cif-deposit CGI script.	7249837.cif