Crystallography Open Database

Information card for entry 4345765

Preview

Coordinates	4345765.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34.25 H43 Br3 Dy N6 O16.5 Zn
Calculated formula	C34.25 H43 Br3 Dy N6 O16.5 Zn
Title of publication	Designing Ligands to Isolate ZnLn and Zn2Ln Complexes: Field-Induced Single-Ion Magnet Behavior of the ZnDy, Zn2Dy, and Zn2Er Analogues.
Authors of publication	Fondo, Matilde; Corredoira-Vázquez, Julio; García-Deibe, Ana M; Sanmartín-Matalobos, Jesús; Herrera, Juan Manuel; Colacio, Enrique
Journal of publication	Inorganic chemistry
Year of publication	2017
Journal volume	56
Journal issue	10
Pages of publication	5646 - 5656
a	10.8136 ± 0.0006 Å
b	15.4254 ± 0.0009 Å
c	27.1409 ± 0.0015 Å
α	90°
β	97.725 ± 0.003°
γ	90°
Cell volume	4486.1 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1176
Residual factor for significantly intense reflections	0.0582
Weighted residual factors for significantly intense reflections	0.1199
Weighted residual factors for all reflections included in the refinement	0.1394
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
197402 (current)	2017-06-05	cif/ Updating files of 4345764, 4345765 Original log message: Adding full bibliography for 4345764--4345765.cif.	4345765.cif
195870	2017-04-30	cif/ Adding structures of 4345765 via cif-deposit CGI script.	4345765.cif