Crystallography Open Database

Information card for entry 7118151

Preview

Coordinates	7118151.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	catena-[Co3(dpa)4ZrF6] DMF solvate
Formula	C46 H46 Co3 F6 N14 O2 Zr
Calculated formula	C46 H32 Co3 F6 N14 O2 Zr
Title of publication	One-dimensional coordination polymers of [Co3(dpa)4]^2+^ and [MF6]^2-^ (M = ReIV, ZrIV and SnIV)
Authors of publication	Vladimir Bulicanu; Kasper S. Pedersen; Mathieu Rouzieres; Jesper Bendix; Pierre Dechambenoit; Rodolphe Clerac; Elizabeth A. Hillard
Journal of publication	Chem.Commun.
Year of publication	2015
Journal volume	51
Pages of publication	17748
a	13.6527 ± 0.0004 Å
b	13.6527 ± 0.0004 Å
c	25.7947 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	4808 ± 0.2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	7
Space group number	130
Hermann-Mauguin space group symbol	P 4/n c c
Hall space group symbol	-P 4a 2ac
Residual factor for all reflections	0.0853
Residual factor for significantly intense reflections	0.0496
Weighted residual factors for significantly intense reflections	0.1128
Weighted residual factors for all reflections included in the refinement	0.1331
Goodness-of-fit parameter for all reflections included in the refinement	1.113
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
171417 (current)	2015-12-10	cif/ Adding structures of 7118150, 7118151, 7118152, 7118153 via cif-deposit CGI script.	7118151.cif