Crystallography Open Database

Information card for entry 1561296

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Coordinates	1561296.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H42 N4 O14 Zn3
Calculated formula	C50 H42 N4 O14 Zn3
Title of publication	A metal-organic framework based on nanosized hexagonal channels as fluorescent indicator for detection of nitroaromatic explosives
Authors of publication	Hu, Xiao-Li; Wang, Xin-Long; Su, Zhong-Min
Journal of publication	Journal of Solid State Chemistry
Year of publication	2018
Journal volume	258
Pages of publication	781 - 785
a	42.436 ± 0.005 Å
b	42.436 ± 0.005 Å
c	27.473 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	42846 ± 9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.2298
Residual factor for significantly intense reflections	0.1533
Weighted residual factors for significantly intense reflections	0.3997
Weighted residual factors for all reflections included in the refinement	0.4527
Goodness-of-fit parameter for all reflections included in the refinement	1.499
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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