Crystallography Open Database

Information card for entry 7721039

Preview

Coordinates	7721039.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36.08 H31.67 Cl0.18 F3 Li O4.75 P2
Calculated formula	C36.087 H31.674 Cl0.174 F3 Li O4.75 P2
Title of publication	Spacer-Tuned Diphosphine Dioxides as Preorganised Co-Ligands for Synergistic Lithium Extraction with β-Diketonates †
Authors of publication	Zhao, Yunze; Zhang, Jianfeng; Li, Sai; Schwedtmann, Kevin; Wenzel, Marco; Doert, Thomas; Xing, Huifang; Yang, Liangrong; Weigand, Jan J.
Journal of publication	Dalton Transactions
Year of publication	2026
a	12.5215 ± 0.0007 Å
b	12.728 ± 0.0006 Å
c	13.3509 ± 0.0006 Å
α	64.326 ± 0.005°
β	89.184 ± 0.004°
γ	65.971 ± 0.005°
Cell volume	1717.19 ± 0.19 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0559
Residual factor for significantly intense reflections	0.0498
Weighted residual factors for significantly intense reflections	0.1317
Weighted residual factors for all reflections included in the refinement	0.1378
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
305999 (current)	2026-05-19	cif/ Adding structures of 7721038, 7721039 via cif-deposit CGI script.	7721039.cif