Crystallography Open Database

Information card for entry 1558268

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Coordinates	1558268.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Dipotassium catena-mu-[Tetraacetatocuprato(II)][tetrakis-mu-(acetato-O,O')dicopper(II)]
Formula	C16 H24 Cu3 K2 O16
Calculated formula	C16 Cu3 K2 O16
SMILES	[K+].[K+].[K+].[K+].[Cu]1234([O]=C(C)O[Cu]4([O]=C(O1)C)(OC(=[O]3)C)[O]=C(O2)C)[O]=C(C)O[Cu]12(OC(=[O]1)C)(OC(=[O]2)C)OC(C)=[O][Cu]1234[O]=C(C)O[Cu]2([O]=C(O1)C)(OC(=[O]4)C)([O]=C(O3)C)[O]=C(C)O[Cu]12(OC(=[O]2)C)(OC(=[O]1)C)OC(=O)C
Title of publication	Crystal Structure of Dipotassium catena-mu-[Tetraacetatocuprato(II)][tetrakis-mu-(acetato-O,O')dicopper(II)]
Authors of publication	Valo, Jaana; Nasakkala, Matti
Journal of publication	Acta Chemica Scandinavica
Year of publication	1994
Journal volume	48
Pages of publication	20 - 24
a	17.956 ± 0.004 Å
b	14.313 ± 0.003 Å
c	12.443 ± 0.002 Å
α	90°
β	98.85 ± 0.03°
γ	90°
Cell volume	3159.8 ± 1.1 Å³
Ambient diffraction temperature	294 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.042
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
253037 (current)	2020-06-09	cif/ Adding structures of 1558268 via cif-deposit CGI script.	1558268.cif