Crystallography Open Database

Information card for entry 7229759

Preview

Coordinates	7229759.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H45.01 Cu5 N4 O24
Calculated formula	C56 H45.014 Cu5 N4 O24
Title of publication	Single-crystal-to-single-crystal (SCSC) transformation and dissolution‒recrystallization structural transformation (DRST) among three new copper(ii) coordination polymers
Authors of publication	Zhang, Xiao-Feng; Yan, Tong; Wang, Tao; Feng, Jing; Wang, Quan; Wang, Xiao; Du, Lin; Zhao, Qi-Hua
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	5
Pages of publication	570
a	25.368 ± 0.005 Å
b	16.9 ± 0.003 Å
c	14.759 ± 0.004 Å
α	90°
β	96.855 ± 0.003°
γ	90°
Cell volume	6282 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.195
Residual factor for significantly intense reflections	0.0777
Weighted residual factors for significantly intense reflections	0.1918
Weighted residual factors for all reflections included in the refinement	0.2358
Goodness-of-fit parameter for all reflections included in the refinement	0.943
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
228955 (current)	2019-11-17	cif/ Updating files of 7229758, 7229759, 7229760 Original log message: Adding full bibliography for 7229758--7229760.cif.	7229759.cif
204301	2017-12-16	cif/ Adding structures of 7229758, 7229759, 7229760 via cif-deposit CGI script.	7229759.cif