Crystallography Open Database

Information card for entry 7061064

Preview

Coordinates	7061064.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H21 N5 O5 Zn
Calculated formula	C33 H21 N5 O5 Zn
Title of publication	A multi-responsive MOF-based fluorescent probe for detecting Fe3+, Cr2O72− and acetylacetone
Authors of publication	Li, Jing; Wu, Lin-Hui; Yao, Shu-Li; Xu, Hui; Zheng, Teng-Fei; Liu, Sui-Jun; Chen, Jing-Lin; Wen, He-Rui
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	48
Pages of publication	22915 - 22923
a	10.5282 ± 0.0006 Å
b	12.3363 ± 0.0006 Å
c	13.9052 ± 0.0009 Å
α	100.973 ± 0.002°
β	108.398 ± 0.002°
γ	103.231 ± 0.002°
Cell volume	1599.37 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1155
Residual factor for significantly intense reflections	0.0581
Weighted residual factors for significantly intense reflections	0.1129
Weighted residual factors for all reflections included in the refinement	0.1314
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
271864 (current)	2022-01-06	cif/ Updating files of 7061064 Original log message: Adding full bibliography for 7061064.cif.	7061064.cif
270631	2021-11-13	cif/ Adding structures of 7061064 via cif-deposit CGI script.	7061064.cif