Crystallography Open Database

Information card for entry 7715206

Preview

Coordinates	7715206.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H46 Br4 Cl2 Cu5 Dy2 N4 O20
Calculated formula	C38 H46 Br4 Cl2 Cu5 Dy2 N4 O20
Title of publication	A heptanuclear {Dy<sub>2</sub>Cu<sub>5</sub>} complex as a single-molecule magnet.
Authors of publication	Mičová, Romana; Rajnák, Cyril; Titiš, Ján; Moncoľ, Ján; Nováčiková, Jana; Bieńko, Alina; Boča, Roman
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	11
Pages of publication	5147 - 5151
a	10.7667 ± 0.0002 Å
b	12.5061 ± 0.0003 Å
c	15.2672 ± 0.0003 Å
α	66.153 ± 0.002°
β	69.597 ± 0.002°
γ	74.811 ± 0.002°
Cell volume	1744.6 ± 0.07 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0594
Residual factor for significantly intense reflections	0.0496
Weighted residual factors for significantly intense reflections	0.1371
Weighted residual factors for all reflections included in the refinement	0.143
Goodness-of-fit parameter for all reflections included in the refinement	1.111
Diffraction radiation wavelength	1.54186 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
290964 (current)	2024-04-05	cif/ Updating files of 7715206 Original log message: Adding full bibliography for 7715206.cif.	7715206.cif
289919	2024-02-22	cif/ Adding structures of 7715206 via cif-deposit CGI script.	7715206.cif