Crystallography Open Database

Information card for entry 7049608

Preview

Coordinates	7049608.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H40 O2 Y2
Calculated formula	C32 H40 O2 Y2
Title of publication	Versatility of cyclooctatetraenyl ligands in rare earth metal complexes of the [M<sub>2</sub>(COT)<sub>3</sub>(THF)<sub>2</sub>] (M = Y and La) type.
Authors of publication	Greenough, Joshua; Zhou, Zheng; Wei, Zheng; Petrukhina, Marina A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	17
Pages of publication	5614 - 5620
a	15.6822 ± 0.0006 Å
b	13.3019 ± 0.0005 Å
c	13.5299 ± 0.0005 Å
α	90°
β	95.547 ± 0.001°
γ	90°
Cell volume	2809.16 ± 0.18 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.075
Residual factor for significantly intense reflections	0.0617
Weighted residual factors for significantly intense reflections	0.1589
Weighted residual factors for all reflections included in the refinement	0.1659
Goodness-of-fit parameter for all reflections included in the refinement	1.148
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
224099 (current)	2019-11-07	cif/ Updating files of 7049607, 7049608 Original log message: Adding full bibliography for 7049607--7049608.cif.	7049608.cif
214551	2019-04-09	cif/ Adding structures of 7049607, 7049608 via cif-deposit CGI script.	7049608.cif