Crystallography Open Database

Information card for entry 1572120

Preview

Coordinates	1572120.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H24 O4
Calculated formula	C18 H24 O4
Title of publication	Asymmetric total syntheses of sarglamides A, C, D, E, and F.
Authors of publication	Kim, Ryungwoo; Wu, Yanting; Tong, Rongbiao
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	32
Pages of publication	12856 - 12860
a	10.29909 ± 0.00012 Å
b	10.79136 ± 0.00013 Å
c	27.3078 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3035.02 ± 0.06 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	3
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0389
Residual factor for significantly intense reflections	0.0344
Weighted residual factors for significantly intense reflections	0.0834
Weighted residual factors for all reflections included in the refinement	0.0869
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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
294467 (current)	2024-09-06	cif/ Updating files of 1572120 Original log message: Adding full bibliography for 1572120.cif.	1572120.cif
293342	2024-07-10	cif/ Adding structures of 1572120 via cif-deposit CGI script.	1572120.cif