Crystallography Open Database

Information card for entry 1569458

Preview

Coordinates	1569458.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H12 N4 O4 Zn
Calculated formula	C15 H12 N4 O4 Zn
Title of publication	Synthesis, Crystal Structure, and Luminescent Sensing Properties of a Supramolecular 3D Zinc(II) Metal–Organic Framework with Terephthalate and Bis(imidazol-1-yl)methane Linkers
Authors of publication	Matveevskaya, Vladislava V.; Pavlov, Dmitry I.; Ryadun, Alexey A.; Fedin, Vladimir P.; Potapov, Andrei S.
Journal of publication	Inorganics
Year of publication	2023
Journal volume	11
Journal issue	7
Pages of publication	264
a	18.3186 ± 0.0003 Å
b	18.3186 ± 0.0003 Å
c	11.6298 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	3902.62 ± 0.16 Å³
Cell temperature	290 ± 2 K
Ambient diffraction temperature	290 ± 2 K
Number of distinct elements	5
Space group number	86
Hermann-Mauguin space group symbol	P 42/n :2
Hall space group symbol	-P 4bc
Residual factor for all reflections	0.0487
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0898
Weighted residual factors for all reflections included in the refinement	0.0965
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
285003 (current)	2023-07-06	cif/ Adding structures of 1569458 via cif-deposit CGI script.	1569458.cif