Crystallography Open Database

Information card for entry 4518753

Preview

Coordinates	4518753.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H30 O6
Calculated formula	C30 H30 O6
Title of publication	Trifluoroacetic Acid-Mediated Oxidative Self-Condensation of Acetophenones in the Presence of SeO2: A Serendipitous Approach for the Synthesis of Fused [1,3]Dioxolo[4,5-d][1,3]dioxoles
Authors of publication	Marpna, Ibakyntiew D.; Shangpliang, O. Risuklang; Wanniang, Kmendashisha; Kshiar, Baskhemlang; Lipon, Tyrchain Mitre; Laloo, Badaker M.; Myrboh, Bekington
Journal of publication	ACS Omega
Year of publication	2021
a	9.1302 ± 0.0006 Å
b	11.5971 ± 0.001 Å
c	12.5478 ± 0.0009 Å
α	103.762 ± 0.007°
β	96.584 ± 0.006°
γ	90.048 ± 0.006°
Cell volume	1281.41 ± 0.17 Å³
Cell temperature	293.55 ± 0.11 K
Ambient diffraction temperature	293.55 ± 0.11 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0815
Residual factor for significantly intense reflections	0.0502
Weighted residual factors for significantly intense reflections	0.1147
Weighted residual factors for all reflections included in the refinement	0.1271
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
265593 (current)	2021-05-29	cif/ Adding structures of 4518748, 4518749, 4518750, 4518751, 4518752, 4518753 via cif-deposit CGI script.	4518753.cif