Crystallography Open Database

Information card for entry 4104304

Preview

Coordinates	4104304.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	C18H28O3
Formula	C18 H28 O3
Calculated formula	C18 H28 O3
Title of publication	Stereoselective Synthesis and Osteogenic Activity of Subglutinols A and B
Authors of publication	Hyoungsu Kim; Joseph B. Baker; Su-Ui Lee; Yongho Park; Kyle L. Bolduc; Hyung-Bae Park; Marina G. Dickens; Dong-Sup Lee; Yongchul Kim; Seong Hwan Kim; Jiyong Hong
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	3192 - 3194
a	8.5896 ± 0.0003 Å
b	10.1995 ± 0.0003 Å
c	37.4208 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	3278.42 ± 0.18 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 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	0.0524
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.1066
Weighted residual factors for all reflections included in the refinement	0.1167
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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