Crystallography Open Database

Information card for entry 1570841

Preview

Coordinates	1570841.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	1D-DGIST-18'
Formula	C22 H17 N O8 S Zn
Calculated formula	C22 H17 N O8 S Zn
Title of publication	Solvent-induced structural transformation in a one-dimensional coordination polymer.
Authors of publication	Jin, Kangwoo; Park, Nohyoon; Ahn, Yongdeok; Seo, Daeha; Moon, Dohyun; Sung, Jooyoung; Park, Jinhee
Journal of publication	Nanoscale
Year of publication	2024
Journal volume	16
Journal issue	9
Pages of publication	4571 - 4577
a	8.563 ± 0.0017 Å
b	16.995 ± 0.003 Å
c	17.633 ± 0.004 Å
α	90°
β	101.24 ± 0.03°
γ	90°
Cell volume	2516.9 ± 0.9 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.1845
Residual factor for significantly intense reflections	0.1148
Weighted residual factors for significantly intense reflections	0.3481
Weighted residual factors for all reflections included in the refinement	0.3789
Goodness-of-fit parameter for all reflections included in the refinement	1.185
Diffraction radiation wavelength	0.7 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
291006 (current)	2024-04-05	cif/ Updating files of 1570840, 1570841, 1570842 Original log message: Adding full bibliography for 1570840--1570842.cif.	1570841.cif
289224	2024-01-31	cif/ Adding structures of 1570840, 1570841, 1570842 via cif-deposit CGI script.	1570841.cif