Crystallography Open Database

Information card for entry 7036971

Preview

Coordinates	7036971.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H32 Cl Co F12 Li2 N O6
Calculated formula	C28 H32 Cl Co F12 Li2 N O6
Title of publication	Synthesis and characterization of a family of M(2+) complexes supported by a trianionic ONO(3-) pincer-type ligand: towards the stabilization of high-spin square-planar complexes.
Authors of publication	Pascualini, M. E.; Stoian, S. A.; Ozarowski, A.; Di Russo, N. V.; Thuijs, A. E.; Abboud, K. A.; Christou, G.; Veige, A. S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	46
Pages of publication	20207 - 20215
a	13.7122 ± 0.0014 Å
b	14.9092 ± 0.0015 Å
c	17.2336 ± 0.0018 Å
α	90°
β	98.473 ± 0.002°
γ	90°
Cell volume	3484.7 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0551
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0888
Weighted residual factors for all reflections included in the refinement	0.0941
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
171123 (current)	2015-12-09	cif/ Updating files of 7036971, 7036972, 7036973 Original log message: Adding full bibliography for 7036971--7036973.cif.	7036971.cif
169878	2015-10-30	cif/ Adding structures of 7036971, 7036972, 7036973 via cif-deposit CGI script.	7036971.cif