Crystallography Open Database

Information card for entry 7232615

Preview

Coordinates	7232615.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H21 N O3 S
Calculated formula	C19 H21 N O3 S
Title of publication	K3PO4-promoted domino reactions: diastereoselective synthesis of trans-2,3-dihydrobenzofurans from salicyl N-tert-butanesulfinyl imines and sulfur ylides
Authors of publication	Zhang, Minxuan; Lu, Tianyu; Zhao, Yun; Xie, Guixian; Miao, Zhiwei
Journal of publication	RSC Advances
Year of publication	2019
Journal volume	9
Journal issue	21
Pages of publication	11978
a	9.1621 ± 0.0002 Å
b	11.5165 ± 0.0002 Å
c	17.1645 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	1811.12 ± 0.07 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	5
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	0.0303
Residual factor for significantly intense reflections	0.0281
Weighted residual factors for significantly intense reflections	0.0701
Weighted residual factors for all reflections included in the refinement	0.071
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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