Crystallography Open Database

Information card for entry 7713956

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Coordinates	7713956.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H14 N6 O8 Tb0.07 Zn1.93
Calculated formula	C23 H14 N6 O8 Tb0.064 Zn1.936
Title of publication	The gas-selective Zn-MOF exhibits selective sensing of Fe3+ ions by doping with Tb3+
Authors of publication	Wang, Zhi Gang; Ding, Tao; Fei, Jie
Journal of publication	Dalton Transactions
Year of publication	2023
a	18.4369 ± 0.0008 Å
b	19.0618 ± 0.0008 Å
c	14.3162 ± 0.0006 Å
α	90°
β	126.119 ± 0.001°
γ	90°
Cell volume	4064.3 ± 0.3 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.057
Residual factor for significantly intense reflections	0.0524
Weighted residual factors for significantly intense reflections	0.1592
Weighted residual factors for all reflections included in the refinement	0.1631
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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