Crystallography Open Database

Information card for entry 7240013

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Coordinates	7240013.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H37.5 Cd2 Cl4 N6 O11.75
Calculated formula	C45 H30 Cd2 Cl4 N6 O8
Title of publication	Five water-stable luminescent CdII-based metal-organic frameworks as sensors for highly sensitive and selective detection of acetylacetone, Fe3+ and Cr2O72- ions
Authors of publication	Yong-Sheng, Shi; Liu, Dong; Fu, Lianshe; Li, Yuehua; Dong, Gui-Ying
Journal of publication	CrystEngComm
Year of publication	2020
a	18.4777 ± 0.0004 Å
b	9.4892 ± 0.0002 Å
c	26.8332 ± 0.0004 Å
α	90°
β	91.811 ± 0.002°
γ	90°
Cell volume	4702.55 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0593
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.0796
Weighted residual factors for all reflections included in the refinement	0.0875
Goodness-of-fit parameter for all reflections included in the refinement	0.989
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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