Crystallography Open Database

Information card for entry 1573614

Preview

Coordinates	1573614.cif
Original IUCr paper	HTML

Structure parameters

Common name	Tetraphenylglycolide tetrahydrofuran monosolvate
Chemical name	3,3,6,6-Tetraphenyl-1,4-dioxane-2,5-dione tetrahydrofuran monosolvate
Formula	C32 H24 O5
Calculated formula	C32 H24 O5
Title of publication	Tetraphenylglycolide tetrahydrofuran monosolvate
Authors of publication	Ndima, Lubabalo; Hosten, Eric Cyriel; Betz, Richard
Journal of publication	IUCrData
Year of publication	2025
Journal volume	10
Journal issue	1
Pages of publication	x241241
a	9.5725 ± 0.0003 Å
b	9.5725 ± 0.0003 Å
c	27.576 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	2526.86 ± 0.15 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	3
Space group number	96
Hermann-Mauguin space group symbol	P 43 21 2
Hall space group symbol	P 4nw 2abw
Residual factor for all reflections	0.0616
Residual factor for significantly intense reflections	0.0564
Weighted residual factors for significantly intense reflections	0.1711
Weighted residual factors for all reflections included in the refinement	0.1759
Goodness-of-fit parameter for all reflections included in the refinement	1.091
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
300370 (current)	2025-07-05	Updating bibliography information from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	1573614.cif
297209	2025-01-08	cif/ Adding structures of 1573614 via cif-deposit CGI script.	1573614.cif