Crystallography Open Database

Information card for entry 7058025

Preview

Coordinates	7058025.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H30 N2 O7 Zn
Calculated formula	C25 H30 N2 O7 Zn
Title of publication	Zinc-based CPs for effective detection of Fe3+ and Cr2O72− ions
Authors of publication	Zhu, Rong-Rong; Wang, Tao; Wang, Da-Wei; Yan, Tong; Wang, Quan; Li, Hang-Xing; Xue, Zhe; Zhou, Jie; Du, Lin; Zhao, Qi-Hua
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	3
Pages of publication	1494
a	7.5609 ± 0.0008 Å
b	19.205 ± 0.002 Å
c	17.8092 ± 0.0019 Å
α	90°
β	98.426 ± 0.001°
γ	90°
Cell volume	2558.1 ± 0.5 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/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0841
Residual factor for significantly intense reflections	0.0561
Weighted residual factors for significantly intense reflections	0.161
Weighted residual factors for all reflections included in the refinement	0.1782
Goodness-of-fit parameter for all reflections included in the refinement	1.018
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
225016 (current)	2019-11-08	cif/ Updating files of 7058023, 7058024, 7058025, 7058026 Original log message: Adding full bibliography for 7058023--7058026.cif.	7058025.cif
212425	2018-12-07	cif/ Adding structures of 7058023, 7058024, 7058025, 7058026 via cif-deposit CGI script.	7058025.cif