Crystallography Open Database

Information card for entry 4001561

Preview

Coordinates	4001561.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	terbium dicyanamide dihydrate
Chemical name	terbium dicyanamide dihydrate
Formula	C6 H4 N9 O2 Tb
Calculated formula	C6 H4 N9 O2 Tb
Title of publication	Synthesis and Characterization of Tb[N(CN)2]3·2H2O and Eu[N(CN)2]3·2H2O: Two New Luminescent Rare-Earth Dicyanamides
Authors of publication	Nag, Abanti; Schmidt, Peter J.; Schnick, Wolfgang
Journal of publication	Chemistry of Materials
Year of publication	2006
Journal volume	18
Journal issue	24
Pages of publication	5738
a	7.4632 ± 0.0015 Å
b	11.523 ± 0.002 Å
c	13.944 ± 0.003 Å
α	90°
β	94.06 ± 0.03°
γ	90°
Cell volume	1196.2 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0334
Residual factor for significantly intense reflections	0.0193
Weighted residual factors for significantly intense reflections	0.0376
Weighted residual factors for all reflections included in the refinement	0.0419
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4001561.cif
120073	2014-07-11	Adding DOIs to range 4/00 structures.	4001561.cif
47628	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 4001561 via cif-deposit CGI script.	4001561.cif