Crystallography Open Database

Information card for entry 7060990

Preview

Coordinates	7060990.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H49 N11 O14 Pr2
Calculated formula	C48.0006 H49 N11 O14 Pr2
Title of publication	Radii-dependent self-assembly polynuclear lanthanide complexes as catalysts for CO2 transformation into cyclic carbonates
Authors of publication	Chen, Changjuan; Zhang, Aijiang
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	43
Pages of publication	20155 - 20163
a	17.4217 ± 0.0014 Å
b	14.681 ± 0.0011 Å
c	27.191 ± 0.002 Å
α	90°
β	106.684 ± 0.002°
γ	90°
Cell volume	6661.8 ± 0.9 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0513
Residual factor for significantly intense reflections	0.0414
Weighted residual factors for significantly intense reflections	0.1122
Weighted residual factors for all reflections included in the refinement	0.1174
Goodness-of-fit parameter for all reflections included in the refinement	1.078
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
271190 (current)	2021-12-07	cif/ Updating files of 7060989, 7060990, 7060991, 7060992, 7060993 Original log message: Adding full bibliography for 7060989--7060993.cif.	7060990.cif
269453	2021-10-03	cif/ Adding structures of 7060989, 7060990, 7060991, 7060992, 7060993 via cif-deposit CGI script.	7060990.cif