Crystallography Open Database

Information card for entry 1562904

Preview

Coordinates	1562904.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H50 Er4 N2 O32
Calculated formula	C54 H50 Er4 N2 O32
Title of publication	Synthesis, crystal structures and properties of lanthanide-organic frameworks based benzene carboxylates with two/three-dimensional structure
Authors of publication	Wang, Ping; Fan, Ruiqing; Yang, Yulin; Liu, Xinrong; Cao, Wenwu; Yang, Bin
Journal of publication	Journal of Solid State Chemistry
Year of publication	2012
Journal volume	196
Pages of publication	441 - 450
a	10.8221 ± 0.0003 Å
b	14.0737 ± 0.0005 Å
c	19.9657 ± 0.0006 Å
α	86.53 ± 0.003°
β	83.51 ± 0.002°
γ	78.798 ± 0.002°
Cell volume	2961.54 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.033
Residual factor for significantly intense reflections	0.0246
Weighted residual factors for significantly intense reflections	0.0536
Weighted residual factors for all reflections included in the refinement	0.0548
Goodness-of-fit parameter for all reflections included in the refinement	0.965
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
265540 (current)	2021-05-27	cif/ Adding structures of 1562900, 1562901, 1562902, 1562903, 1562904 via cif-deposit CGI script.	1562904.cif