Crystallography Open Database

Information card for entry 7232450

Preview

Coordinates	7232450.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H31 N7 O7 Zn
Calculated formula	C34 H31 N7 O7 Zn
Title of publication	Two triphenylamine-based luminescent metal‒organic frameworks as a dual-functional sensor for the detection of nitroaromatic compounds and ofloxacin antibiotic
Authors of publication	Yao, Xiao-Qiang; Xiao, Guo-Bin; Xie, Hua; Qin, Dong-Dong; Ma, Heng-Chang; Liu, Jia-Cheng; Yan, Pen-Ji
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	15
Pages of publication	2559
a	10.772 ± 0.005 Å
b	30.453 ± 0.014 Å
c	10.404 ± 0.005 Å
α	90°
β	102.632 ± 0.007°
γ	90°
Cell volume	3330 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1108
Residual factor for significantly intense reflections	0.071
Weighted residual factors for significantly intense reflections	0.1545
Weighted residual factors for all reflections included in the refinement	0.1646
Goodness-of-fit parameter for all reflections included in the refinement	1.014
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
223681 (current)	2019-11-07	cif/ Updating files of 7232449, 7232450 Original log message: Adding full bibliography for 7232449--7232450.cif.	7232450.cif
213907	2019-03-01	cif/ Adding structures of 7232449, 7232450 via cif-deposit CGI script.	7232450.cif