Crystallography Open Database

Information card for entry 7710949

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Coordinates	7710949.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H22 N4 O7 S Zn
Calculated formula	C25 H16 N4 O4 S Zn
Title of publication	Rational synthesis of a pyridyl-imidazoquinazoline based multifunctional 3D Zn(II)-MOF: structure, luminescence, selective and sensitive detection of Al3+ and TNP, and its semiconducting device application
Authors of publication	Sinha, Chittaranjan; Bairy, Gurupada; Dey, Arka; Dutta, Basudeb; Maity, Suvendu
Journal of publication	Dalton Transactions
Year of publication	2022
a	11.4312 ± 0.0013 Å
b	31.433 ± 0.004 Å
c	57.919 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	20811 ± 4 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273.15 K
Number of distinct elements	6
Space group number	70
Hermann-Mauguin space group symbol	F d d d :2
Hall space group symbol	-F 2uv 2vw
Residual factor for all reflections	0.0898
Residual factor for significantly intense reflections	0.0623
Weighted residual factors for significantly intense reflections	0.1813
Weighted residual factors for all reflections included in the refinement	0.2169
Goodness-of-fit parameter for all reflections included in the refinement	1.1344
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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