Crystallography Open Database

Information card for entry 1573303

Preview

Coordinates	1573303.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Cu(TFSI)2(bip)2
Formula	C22 H24 Cu F12 N10 O8 S4
Calculated formula	C22 H24 Cu F12 N10 O8 S4
Title of publication	Mechanically induced polyamorphism in a one-dimensional coordination polymer.
Authors of publication	Nishiguchi, Taichi; Ohara, Yuki; Kadota, Kentaro; Zheng, Xin; Noro, Shin-Ichiro; Horike, Satoshi
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	2
Pages of publication	621 - 626
a	10.3863 ± 0.0002 Å
b	13.163 ± 0.0002 Å
c	14.3802 ± 0.0004 Å
α	90.6959 ± 0.0018°
β	101.511 ± 0.002°
γ	104.786 ± 0.0018°
Cell volume	1858.52 ± 0.07 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0595
Residual factor for significantly intense reflections	0.0577
Weighted residual factors for significantly intense reflections	0.1617
Weighted residual factors for all reflections included in the refinement	0.1636
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
298120 (current)	2025-03-04	cif/ Updating files of 1573303 Original log message: Adding full bibliography for 1573303.cif.	1573303.cif
296126	2024-11-27	cif/ Adding structures of 1573303 via cif-deposit CGI script.	1573303.cif