Crystallography Open Database

Information card for entry 7248653

Preview

Coordinates	7248653.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H36 Ag4 F20 O17
Calculated formula	C46 H36 Ag4 F20 O17
Title of publication	The atypical solubility of silver(i) pentafluorobenzoate and its use as a catch-and-release agent
Authors of publication	Ward, Jas S.
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	23
Pages of publication	3088 - 3097
a	14.4142 ± 0.0001 Å
b	23.8477 ± 0.0001 Å
c	15.1372 ± 0.0001 Å
α	90°
β	93.326 ± 0.001°
γ	90°
Cell volume	5194.58 ± 0.05 Å³
Cell temperature	120.01 ± 0.1 K
Ambient diffraction temperature	120.01 ± 0.1 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0219
Residual factor for significantly intense reflections	0.0197
Weighted residual factors for significantly intense reflections	0.0524
Weighted residual factors for all reflections included in the refinement	0.0535
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
292979 (current)	2024-07-05	cif/ Updating files of 7248652, 7248653, 7248654, 7248655, 7248656, 7248657, 7248658, 7248659, 7248660, 7248661, 7248662, 7248663, 7248664, 7248665, 7248666 Original log message: Adding full bibliography for 7248652--7248666.cif.	7248653.cif
291962	2024-05-21	cif/ Adding structures of 7248652, 7248653, 7248654, 7248655, 7248656, 7248657, 7248658, 7248659, 7248660, 7248661, 7248662, 7248663, 7248664, 7248665, 7248666 via cif-deposit CGI script.	7248653.cif