Crystallography Open Database

Information card for entry 8106225

Preview

Coordinates	8106225.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H28 Cd Na2 O26
Calculated formula	C20 H28 Cd Na2 O26
Title of publication	Crystal structure of catena-poly[octaaqua-bis(μ2-4,6-dicarboxyisophthalate-κ2 O:O′)cadmium(II)disodium(I)] dihydrate, C20H28CdNa2O26
Authors of publication	Xue, Ya-Li; Zhang, Ai-Yun; Zhao, Dan
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2018
Journal volume	233
Journal issue	4
Pages of publication	591 - 592
a	7.4169 ± 0.0008 Å
b	20.183 ± 0.002 Å
c	10.5403 ± 0.0011 Å
α	90°
β	103.552 ± 0.001°
γ	90°
Cell volume	1533.9 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0521
Residual factor for significantly intense reflections	0.0434
Weighted residual factors for significantly intense reflections	0.1207
Weighted residual factors for all reflections included in the refinement	0.1271
Goodness-of-fit parameter for all reflections included in the refinement	1.124
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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