Crystallography Open Database

Information card for entry 7226462

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Coordinates	7226462.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H23 Cd2 N2 O12
Calculated formula	C29 H23 Cd2 N2 O12
Title of publication	Novel luminescent metal‒organic frameworks based on rigid carboxylate ligands for highly selective sensing of Fe3+ions
Authors of publication	Li, Ling; Li, Chang-Xia; Ren, Yan-Li; Song, Ming; Ma, Yue; Huang, Ru-Dan
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	40
Pages of publication	7787
a	29.218 ± 0.003 Å
b	11.1912 ± 0.0011 Å
c	22.9833 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	7515.2 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.106
Residual factor for significantly intense reflections	0.0662
Weighted residual factors for significantly intense reflections	0.1895
Weighted residual factors for all reflections included in the refinement	0.2155
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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