Crystallography Open Database

Information card for entry 7701515

Preview

Coordinates	7701515.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Co(Aracac)2
Formula	C62 H70 Co O4
Calculated formula	C62 H70 Co O4
Title of publication	Sterically encumbered β-diketonates and base metal catalysis.
Authors of publication	Krajewski, Sebastian M.; Crossman, Aaron S.; Akturk, Eser S.; Suhrbier, Tim; Scappaticci, Steven J.; Staab, Maxwell W.; Marshak, Michael P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	28
Pages of publication	10714 - 10722
a	12.1052 ± 0.0004 Å
b	14.0841 ± 0.0005 Å
c	18.5379 ± 0.0006 Å
α	90.991 ± 0.001°
β	108.95 ± 0.001°
γ	114.429 ± 0.001°
Cell volume	2679.13 ± 0.16 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0525
Residual factor for significantly intense reflections	0.039
Weighted residual factors for significantly intense reflections	0.0872
Weighted residual factors for all reflections included in the refinement	0.0963
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
223294 (current)	2019-11-05	cif/ Adding structures of 7701515, 7701516, 7701517, 7701518, 7701519, 7701520, 7701521 via cif-deposit CGI script.	7701515.cif