Crystallography Open Database

Information card for entry 7160425

Preview

Coordinates	7160425.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H26 N2 O5
Calculated formula	C26 H26 N2 O5
Title of publication	Ruthenium(II)-catalyzed synthesis of poly-substituted furans <i>via</i> intermolecular oxidative annulation of 3-(phenylethynyl) oxazolidin-2-ones.
Authors of publication	Vikram, Vikrant Nawal; Chourasiya, Mohit; Kant, Ruchir; Tadigoppula, Narender
Journal of publication	Organic & biomolecular chemistry
Year of publication	2025
Journal volume	23
Journal issue	15
Pages of publication	3567 - 3571
a	9.5806 ± 0.0002 Å
b	9.2512 ± 0.0002 Å
c	25.933 ± 0.0005 Å
α	90°
β	91.395 ± 0.002°
γ	90°
Cell volume	2297.81 ± 0.08 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0766
Residual factor for significantly intense reflections	0.0641
Weighted residual factors for significantly intense reflections	0.1855
Weighted residual factors for all reflections included in the refinement	0.1989
Goodness-of-fit parameter for all reflections included in the refinement	1.09
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

Version history

Revision	Date	Message	Files
301155 (current)	2025-07-06	cif/ Updating files of 7160425 Original log message: Adding full bibliography for 7160425.cif.	7160425.cif
298497	2025-03-18	cif/ Adding structures of 7160425 via cif-deposit CGI script.	7160425.cif