Crystallography Open Database

Information card for entry 7061525

Preview

Coordinates	7061525.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H19 N O6
Calculated formula	C23 H19 N O6
Title of publication	Convenient construction of polycyclic architectures via multicomponent reaction of amino acids, dialkyl but-2-ynedioates and 2-(o-hydroxyarylidene)-1,3-indanediones
Authors of publication	Liu, Xueyan; Sun, Jing; Yan, Chao-Guo
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	24
Pages of publication	11877 - 11882
a	7.779 ± 0.001 Å
b	10.3103 ± 0.0013 Å
c	13.8093 ± 0.0018 Å
α	101.22 ± 0.004°
β	102.899 ± 0.004°
γ	107.946 ± 0.004°
Cell volume	984.8 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0588
Residual factor for significantly intense reflections	0.0444
Weighted residual factors for significantly intense reflections	0.1124
Weighted residual factors for all reflections included in the refinement	0.1213
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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