Crystallography Open Database

Information card for entry 7112460

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Coordinates	7112460.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H36 N2 O15 Zn2
Calculated formula	C47 H36 N2 O15.006 Zn2
Title of publication	Two novel MOF-74 analogs exhibiting unique luminescent selectivity.
Authors of publication	Liu, Gui-lei; Qin, Yong-jie; Jing, Lei; Wei, Gui-yuan; Li, Hui
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2013
Journal volume	49
Journal issue	17
Pages of publication	1699 - 1701
a	31.8565 ± 0.0009 Å
b	31.8565 ± 0.0009 Å
c	12.6269 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	11097.5 ± 0.7 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0829
Residual factor for significantly intense reflections	0.0789
Weighted residual factors for significantly intense reflections	0.1844
Weighted residual factors for all reflections included in the refinement	0.187
Goodness-of-fit parameter for all reflections included in the refinement	1.083
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7108870
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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