Crystallography Open Database

Information card for entry 2203189

2203188 << 2203189 >> 2203190

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Structure parameters

Chemical name	Di-μ-chloro-bis[(2,2':6,2"-terpyridine-κ^3^N)copper(II)] diperchlorate
Formula	C30 H22 Cl4 Cu2 N6 O8
Calculated formula	C30 H22 Cl4 Cu2 N6 O8
SMILES	c1[n]2c(ccc1)c1cccc3c4cccc[n]4[Cu]42([n]13)[Cl][Cu]12([Cl]4)[n]3ccccc3c3cccc(c4cccc[n]24)[n]13.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
Title of publication	Di-μ-chloro-bis[(2,2':6,2''-terpyridine-κ^3^<i>N</i>)copper(II)] diperchlorate: the triclinic polymorph
Authors of publication	Gilles Gasser; Gaël Labat; Helen Stoeckli-Evans
Journal of publication	Acta Crystallographica Section E
Year of publication	2004
Journal volume	60
Journal issue	2
Pages of publication	m244 - m246
a	6.9905 ± 0.0008 Å
b	9.8696 ± 0.0011 Å
c	23.782 ± 0.002 Å
α	91.431 ± 0.013°
β	93.524 ± 0.013°
γ	102.678 ± 0.014°
Cell volume	1596.5 ± 0.3 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1491
Residual factor for significantly intense reflections	0.068
Weighted residual factors for significantly intense reflections	0.1693
Weighted residual factors for all reflections included in the refinement	0.185
Goodness-of-fit parameter for all reflections included in the refinement	0.971
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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