Crystallography Open Database

Information card for entry 1546898

Preview

Coordinates	1546898.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Er(INNO)(Bza)2(H2O)2]H2O,12nov24i
Formula	C20 H20 Er N O10
Calculated formula	C20 H20 Er N O10
Title of publication	A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour
Authors of publication	Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song
Journal of publication	Dalton Transactions
Year of publication	2017
Journal volume	46
Journal issue	41
Pages of publication	14114 - 14121
a	16.312 ± 0.003 Å
b	14.376 ± 0.002 Å
c	9.5785 ± 0.0015 Å
α	90°
β	93.332 ± 0.002°
γ	90°
Cell volume	2242.4 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
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	0.0359
Residual factor for significantly intense reflections	0.0285
Weighted residual factors for significantly intense reflections	0.0621
Weighted residual factors for all reflections included in the refinement	0.0662
Goodness-of-fit parameter for all reflections included in the refinement	1.049
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
282777 (current)	2023-04-20	cod/ (saulius@starta) Updating COD bibliographies for 271 COD entries identified by R.M.	1546898.cif
199979	2017-08-29	cif/ Adding structures of 1546892, 1546893, 1546894, 1546895, 1546896, 1546897, 1546898 via cif-deposit CGI script.	1546898.cif