Crystallography Open Database

Information card for entry 7062011

7062010 << 7062011 >> 7062012

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Coordinates	7062011.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H20 O4
Calculated formula	C23 H20 O4
Title of publication	A metal-free approach to highly functionalized 3-substituted-3-arylbenzofuran-2(3H)-ones
Authors of publication	Dhotare, Bhaskar B.; Kumar, Sahil; Wadawale, Amey; Nayak, Sandip K.; Kumar, Mukesh; Goswami, Dibakar
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	45
Pages of publication	21906 - 21910
a	18.5957 ± 0.0003 Å
b	11.1708 ± 0.0002 Å
c	18.5559 ± 0.0003 Å
α	90°
β	97.671 ± 0.002°
γ	90°
Cell volume	3820.1 ± 0.11 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	3
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0907
Residual factor for significantly intense reflections	0.0466
Weighted residual factors for significantly intense reflections	0.1385
Weighted residual factors for all reflections included in the refinement	0.1909
Goodness-of-fit parameter for all reflections included in the refinement	1.198
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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