Crystallography Open Database

Information card for entry 4106842

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Coordinates	4106842.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H27 N O
Calculated formula	C22 H27 N O
Title of publication	Total Syntheses of Drimane-Type Sesquiterpenoids Enabled by a Gold-Catalyzed Tandem Reaction
Authors of publication	Hang Shi; Lichao Fang; Ceheng Tan; Lili Shi; Weibin Zhang; Chuang-chuang Li; Tuoping Luo; Zhen Yang
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	14944 - 14947
a	20.741 ± 0.004 Å
b	6.7355 ± 0.0013 Å
c	26.237 ± 0.005 Å
α	90°
β	101.57 ± 0.03°
γ	90°
Cell volume	3590.9 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.156
Residual factor for significantly intense reflections	0.0482
Weighted residual factors for significantly intense reflections	0.0936
Weighted residual factors for all reflections included in the refinement	0.0993
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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