Crystallography Open Database

Information card for entry 2019260

2019259 << 2019260 >> 2019261

Preview

Coordinates	2019260.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Poly[[hexaaqua(μ~4~-benzene-1,2,4,5-tetracarboxylato)dicopper(II)] tetrahydrate]
Formula	C10 H22 Cu2 O18
Calculated formula	C5 H7 Cu O7
Title of publication	The layered structure of poly[[hexaaqua(μ~4~-benzene-1,2,4,5-tetracarboxylato)dicopper(II)] tetrahydrate]
Authors of publication	Cancino, Patricio; Spodine, Evgenia; Paredes-García, Verónica; Venegas-Yazigi, Diego; Vega, Andrés
Journal of publication	Acta Crystallographica Section C
Year of publication	2013
Journal volume	69
Journal issue	11
Pages of publication	1344 - 1347
a	12.1571 ± 0.0003 Å
b	18.1138 ± 0.0004 Å
c	9.637 ± 0.0004 Å
α	90°
β	113.405 ± 0.001°
γ	90°
Cell volume	1947.56 ± 0.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0314
Residual factor for significantly intense reflections	0.0294
Weighted residual factors for significantly intense reflections	0.0814
Weighted residual factors for all reflections included in the refinement	0.0826
Goodness-of-fit parameter for all reflections included in the refinement	1.082
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
176760 (current)	2016-02-20	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01.	2019260.cif
91247	2013-12-09	cif/ Adding structures of 2019260 via cif-deposit CGI script.	2019260.cif