Crystallography Open Database

Information card for entry 7240770

Preview

Coordinates	7240770.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10.25 H4 Na2 O27.5 Tb4
Calculated formula	C10.25 H4 Na2 O27.5 Tb4
Title of publication	Self-assembly of three-dimensional oxalate-bridged alkali(I)-lanthanide(III) heterometal-organic frameworks
Authors of publication	Ponjan, Nutcha; Kielar, Filip; Dungkaew, Winya; Kongpatpanich, Kanokwan; Zenno, Hikaru; Hayami, Shinya; Sukwattanasinitt, Mongkol; Chainok, Kittipong
Journal of publication	CrystEngComm
Year of publication	2020
a	12.5792 ± 0.0004 Å
b	12.5792 ± 0.0004 Å
c	19.2471 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	3045.59 ± 0.19 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	5
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.0524
Residual factor for significantly intense reflections	0.0439
Weighted residual factors for significantly intense reflections	0.1022
Weighted residual factors for all reflections included in the refinement	0.105
Goodness-of-fit parameter for all reflections included in the refinement	1.255
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Diffraction radiation X-ray symbol	K-L~3~
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
253389 (current)	2020-06-24	cif/ Adding structures of 7240769, 7240770, 7240771 via cif-deposit CGI script.	7240770.cif