Crystallography Open Database

Information card for entry 1575903

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Coordinates	1575903.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H23 N O6
Calculated formula	C17 H23 N O6
Title of publication	Construction of α-quinonyl-α-hydroxy/amino acid esters through the redox chain reaction.
Authors of publication	Ye, Yu-Meng; Li, Zhi
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	43
Pages of publication	20564 - 20569
a	9.5963 ± 0.0005 Å
b	9.8669 ± 0.0005 Å
c	18.7412 ± 0.0009 Å
α	90°
β	102.306 ± 0.002°
γ	90°
Cell volume	1733.75 ± 0.15 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1051
Residual factor for significantly intense reflections	0.0639
Weighted residual factors for significantly intense reflections	0.1448
Weighted residual factors for all reflections included in the refinement	0.1664
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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