Crystallography Open Database

Information card for entry 7712194

Preview

Coordinates	7712194.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H74 Ce2 N6 O25 P6
Calculated formula	C78 H72 Ce2 N6 O24.9998 P6
Title of publication	Magnetic and optical studies of a new family of multidimensional and multiproperty PO-lanthanide(III) derived systems.
Authors of publication	Pilichos, Evangelos; Tubau, Ànnia; Speed, Saskia; Font-Bardia, Mercè; Escuer, Albert; Grabulosa, Arnald; Mayans, Júlia
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2023
Journal volume	52
Journal issue	8
Pages of publication	2485 - 2494
a	15.5252 ± 0.0003 Å
b	15.5252 ± 0.0003 Å
c	60.112 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	12547.8 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0826
Residual factor for significantly intense reflections	0.048
Weighted residual factors for significantly intense reflections	0.1138
Weighted residual factors for all reflections included in the refinement	0.1293
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
283250 (current)	2023-05-05	cif/ Updating files of 7712194, 7712195, 7712196 Original log message: Adding full bibliography for 7712194--7712196.cif.	7712194.cif
280613	2023-01-26	cif/ Adding structures of 7712194, 7712195, 7712196 via cif-deposit CGI script.	7712194.cif