Crystallography Open Database

Information card for entry 7064133

Preview

Coordinates	7064133.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H73.33 N O28.67 Tb V2
Calculated formula	C36 H73.3332 N O28.6666 Tb V2
Title of publication	Novel bimetallic LnIII/VIV (Ln = Gd, Tb, Dy, Er, Yb, Lu) compounds with cyclopropane-1,1-dicarboxylate anions and bulky tetrabutylammonium cations: synthesis, structure, magnetic properties, and thermal decomposition
Authors of publication	Bazhina, Evgeniya S.; Shmelev, Maxim A.; Gogoleva, Natalia V.; Matiukhina, Anna K.; Vasilev, Pavel N.; Efimov, Nikolay N.; Kiskin, Mikhail A.; Eremenko, Igor L.
Journal of publication	New Journal of Chemistry
Year of publication	2025
a	15.7396 ± 0.0009 Å
b	21.332 ± 0.001 Å
c	15.4082 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	5173.4 ± 0.4 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
Space group number	52
Hermann-Mauguin space group symbol	P n n a
Hall space group symbol	-P 2a 2bc
Residual factor for all reflections	0.0573
Residual factor for significantly intense reflections	0.0506
Weighted residual factors for significantly intense reflections	0.099
Weighted residual factors for all reflections included in the refinement	0.1018
Goodness-of-fit parameter for all reflections included in the refinement	1.192
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
303397 (current)	2025-11-25	cif/ Adding structures of 7064131, 7064132, 7064133 via cif-deposit CGI script.	7064133.cif