Crystallography Open Database

Information card for entry 1552082

1552081 << 1552082 >> 1552083

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Structure parameters

Chemical name	Poly[diaqua[μ~4~-2-(carboxylatomethoxy)benzoato][μ~2~-2-(carboxylatomethoxy)benzoato]dicadmium(II)]
Formula	C18 H16 Cd2 O12
Calculated formula	C18 H16 Cd2 O12
Title of publication	Poly[diaqua[μ4-2-(carboxylatomethoxy)benzoato][μ2-2-(carboxylatomethoxy)benzoato]dicadmium(II)]
Authors of publication	Gaskin, Gabrielle J.; LaDuca, Robert L.
Journal of publication	IUCrData
Year of publication	2019
Journal volume	4
Journal issue	7
a	6.3966 ± 0.0009 Å
b	11.7504 ± 0.0016 Å
c	13.3579 ± 0.0019 Å
α	104.407 ± 0.001°
β	96.978 ± 0.001°
γ	93.267 ± 0.001°
Cell volume	961.3 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0274
Residual factor for significantly intense reflections	0.0239
Weighted residual factors for significantly intense reflections	0.0546
Weighted residual factors for all reflections included in the refinement	0.0573
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
216923 (current)	2019-07-10	cif/ hkl/ Adding structures of 1552082 via cif-deposit CGI script.	1552082.cif 1552082.hkl