Crystallography Open Database

Information card for entry 7118137

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Coordinates	7118137.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H25 N2.5 O16 Zn4
Calculated formula	C46 H25 N2.5 O16 Zn4
Title of publication	A luminescent dye@MOF as a dual-emitting platform for sensing explosives.
Authors of publication	Hu, Xiao-Li; Qin, Chao; Wang, Xin-Long; Shao, Kui-Zhan; Su, Zhong-Min
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2015
Journal volume	51
Journal issue	99
Pages of publication	17521 - 17524
a	24.736 ± 0.007 Å
b	21.701 ± 0.007 Å
c	25.337 ± 0.007 Å
α	90°
β	109.956 ± 0.005°
γ	90°
Cell volume	12784 ± 7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0958
Residual factor for significantly intense reflections	0.0454
Weighted residual factors for significantly intense reflections	0.0921
Weighted residual factors for all reflections included in the refinement	0.0999
Goodness-of-fit parameter for all reflections included in the refinement	0.778
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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