Crystallography Open Database

Information card for entry 7158773

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Coordinates	7158773.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H20 N O4 P
Calculated formula	C18 H20 N O4 P
Title of publication	Dearomative oxyphosphorylation of indoles enables facile access to 2,2-disubstituted indolin-3-ones.
Authors of publication	Xiong, Ting; Zhou, Xingcui; Jiang, Jun
Journal of publication	Organic & biomolecular chemistry
Year of publication	2022
Journal volume	20
Journal issue	29
Pages of publication	5721 - 5725
a	9.8688 ± 0.0007 Å
b	9.9088 ± 0.0007 Å
c	10.7278 ± 0.0008 Å
α	73.336 ± 0.002°
β	75.766 ± 0.002°
γ	60.403 ± 0.002°
Cell volume	866.99 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0695
Residual factor for significantly intense reflections	0.0589
Weighted residual factors for significantly intense reflections	0.158
Weighted residual factors for all reflections included in the refinement	0.1673
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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