Crystallography Open Database

Information card for entry 7063475

Preview

Coordinates	7063475.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H28 Ce N5 Ni O15
Calculated formula	C21 H28 Ce N5 Ni O15
Title of publication	Two Ni/Ce complexes based on bicompartmental ligands with field supported slow magnetic relaxation
Authors of publication	Krešáková, Lenka; Litecká, Miroslava; Oyarzabal, Itziar; Titiš, Ján; Červeňáková, Michaela; Hillard, Elizabeth A.; Robert, Jerome; Černák, Juraj
Journal of publication	New Journal of Chemistry
Year of publication	2024
a	8.8746 ± 0.0001 Å
b	16.048 ± 0.0002 Å
c	10.0771 ± 0.0001 Å
α	90°
β	91.844 ± 0.001°
γ	90°
Cell volume	1434.43 ± 0.03 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0622
Residual factor for significantly intense reflections	0.0621
Weighted residual factors for significantly intense reflections	0.1577
Weighted residual factors for all reflections included in the refinement	0.158
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7063475.html