Crystallography Open Database

Information card for entry 7718314

Preview

Coordinates	7718314.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H30 F3 N4 Na O10 S U
Calculated formula	C26 H30 F3 N4 Na O10 S U
Title of publication	Macrocyclic Control of Electron Transfer to High Valent Uranium in Heterobimetallic Complexes
Authors of publication	Kumar, Amit; Golwankar, Riddhi; Pyrch, Mikaela; Cooper, Fynn; Arehart, Grant; Carter, Korey Prescott; Oliver, Allen Grayson; Day, Victor W.; Forbes, Tori; Blakemore, James
Journal of publication	Dalton Transactions
Year of publication	2025
a	9.7725 ± 0.0003 Å
b	12.1131 ± 0.0004 Å
c	14.1658 ± 0.0005 Å
α	75.1951 ± 0.0011°
β	80.6655 ± 0.0012°
γ	73.5073 ± 0.001°
Cell volume	1547.22 ± 0.09 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0232
Residual factor for significantly intense reflections	0.0227
Weighted residual factors for significantly intense reflections	0.0564
Weighted residual factors for all reflections included in the refinement	0.0568
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
298420 (current)	2025-03-13	cif/ Adding structures of 7718311, 7718312, 7718313, 7718314, 7718315, 7718316, 7718317, 7718318, 7718319, 7718320 via cif-deposit CGI script.	7718314.cif