Crystallography Open Database

Information card for entry 4302822

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Coordinates	4302822.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H16 O12 Zn2
Calculated formula	C10 H16 O12 Zn2
Title of publication	Conformation Preference of a Flexible Cyclohexanetetracarboxylate Ligand in Three New Metal-Organic Frameworks: Structures, Magnetic and Luminescent Properties
Authors of publication	Rongming Wang; Jian Zhang; Lijuan Li
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	7194 - 7200
a	9.0159 ± 0.0006 Å
b	8.4164 ± 0.0005 Å
c	19.0635 ± 0.0012 Å
α	90°
β	102.912 ± 0.001°
γ	90°
Cell volume	1409.99 ± 0.15 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.0304
Residual factor for significantly intense reflections	0.0253
Weighted residual factors for significantly intense reflections	0.0594
Weighted residual factors for all reflections included in the refinement	0.0614
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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