Crystallography Open Database

Information card for entry 8000058

Preview

Coordinates	8000058.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H34 O10
Calculated formula	C29 H34 O9.875
Title of publication	A Novel Diterpenoid from Euphorbia fischeriana
Authors of publication	Yu-Bo Wang; Guang-Min Yao; Hong-Bing Wang; Guo-Wei Qin
Journal of publication	Chemistry Letters
Year of publication	2005
Journal volume	34
Journal issue	8
Pages of publication	1160
a	7.6049 ± 0.0006 Å
b	20.3114 ± 0.0017 Å
c	19.2794 ± 0.0015 Å
α	90°
β	91.721 ± 0.002°
γ	90°
Cell volume	2976.7 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1196
Residual factor for significantly intense reflections	0.066
Weighted residual factors for significantly intense reflections	0.1836
Weighted residual factors for all reflections included in the refinement	0.1995
Goodness-of-fit parameter for all reflections included in the refinement	0.919
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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