Crystallography Open Database

Information card for entry 7135444

Preview

Coordinates	7135444.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B4 O12 Pr V3
Calculated formula	B4 O12 Pr V3
Title of publication	REV<sub>3</sub>(BO<sub>3</sub>)<sub>4</sub> (RE = La-Nd): a series of rare earth vanadoborates exhibit large birefringence induced by distorted V<sup>III</sup>O<sub>6</sub> groups.
Authors of publication	Wei, Yu-Long; Yao, Wen-Dong; Lv, Yi-Lei; Ma, Liang; Tang, Ru-Ling
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2026
a	7.5419 ± 0.0009 Å
b	9.6567 ± 0.0013 Å
c	11.5679 ± 0.0014 Å
α	90°
β	104.864 ± 0.004°
γ	90°
Cell volume	814.3 ± 0.18 Å³
Cell temperature	273.15 K
Ambient diffraction temperature	273.15 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0244
Residual factor for significantly intense reflections	0.0205
Weighted residual factors for significantly intense reflections	0.0373
Weighted residual factors for all reflections included in the refinement	0.0381
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
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/7135444.html