Crystallography Open Database

Information card for entry 7708511

Preview

Coordinates	7708511.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C156 H116 N10 O26 Pr4 S6
Calculated formula	C156 H116 N10 O26 Pr4 S6
Title of publication	New Ln-MOFs based on mixed organic ligands: synthesis, structure and efficient luminescence sensing of the Hg2+ ion in aqueous solutions
Authors of publication	Wang, Shu-ju; Li, Qian; Xiu, Guan-Lin; You, Li-Xin; Ding, Fu; Van Deun, Rik; Dragutan, Ileana; Dragutan, Valerian; Sun, Yaguang
Journal of publication	Dalton Transactions
Year of publication	2021
a	11.6366 ± 0.0002 Å
b	22.1801 ± 0.0003 Å
c	29.5908 ± 0.0003 Å
α	70.754 ± 0.001°
β	89.232 ± 0.001°
γ	80.429 ± 0.001°
Cell volume	7103.17 ± 0.18 Å³
Cell temperature	296.8 ± 0.7 K
Ambient diffraction temperature	296.8 ± 0.7 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0809
Residual factor for significantly intense reflections	0.063
Weighted residual factors for significantly intense reflections	0.1825
Weighted residual factors for all reflections included in the refinement	0.1963
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
269802 (current)	2021-10-07	cif/ Adding structures of 7708511, 7708512, 7708513, 7708514 via cif-deposit CGI script.	7708511.cif