Crystallography Open Database

Information card for entry 2018914

2018913 << 2018914 >> 2018915

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Structure parameters

Chemical name	<i>catena</i>-poly[[copper(II)-bis[μ-3-carboxy-5-[(imidazol-1-yl)methyl]benzoato]] dimethylacetamide disolvate]
Formula	C32 H36 Cu N6 O10
Calculated formula	C32 H36 Cu N6 O10
Title of publication	A one-dimensional coordination polymer of 5-[(imidazol-1-yl)methyl]benzene-1,3-dicarboxylic acid with Cu^II^ cations
Authors of publication	Patra, Ranjan; Goldberg, Israel
Journal of publication	Acta Crystallographica Section C
Year of publication	2013
Journal volume	69
Journal issue	4
Pages of publication	344 - 347
a	7.7557 ± 0.0002 Å
b	21.9826 ± 0.0004 Å
c	9.816 ± 0.0003 Å
α	90°
β	102.92 ± 0.0009°
γ	90°
Cell volume	1631.17 ± 0.07 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
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	0.0786
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1161
Weighted residual factors for all reflections included in the refinement	0.1294
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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