Crystallography Open Database

Information card for entry 4344029

Preview

Coordinates	4344029.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80 H113 Dy4 N5 O27
Calculated formula	C80 H109 Dy4 N5 O27
Title of publication	Tetranuclear and Pentanuclear Compounds of the Rare-Earth Metals: Synthesis and Magnetism.
Authors of publication	Yadav, Munendra; Mondal, Abhishake; Mereacre, Valeriu; Jana, Salil Kumar; Powell, Annie K.; Roesky, Peter W.
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	16
Pages of publication	7846 - 7856
a	31.154 ± 0.006 Å
b	11.549 ± 0.002 Å
c	24.197 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	8706 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0791
Residual factor for significantly intense reflections	0.0555
Weighted residual factors for significantly intense reflections	0.1282
Weighted residual factors for all reflections included in the refinement	0.1419
Goodness-of-fit parameter for all reflections included in the refinement	0.979
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
160495 (current)	2015-10-06	cif/ Updating files of 4344028, 4344029, 4344030, 4344031 Original log message: Adding full bibliography for 4344028--4344031.cif.	4344029.cif
152588	2015-07-29	cif/ Adding structures of 4344029 via cif-deposit CGI script.	4344029.cif