Crystallography Open Database

Information card for entry 7229760

Preview

Coordinates	7229760.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H30 Cu2 N2 O16
Calculated formula	C28 H32 Cu2 N2 O16
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	7.7303 ± 0.0009 Å
b	10.2721 ± 0.0012 Å
c	19.828 ± 0.002 Å
α	100.406 ± 0.001°
β	93.79 ± 0.001°
γ	99.123 ± 0.001°
Cell volume	1521.7 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0578
Residual factor for significantly intense reflections	0.0399
Weighted residual factors for significantly intense reflections	0.1037
Weighted residual factors for all reflections included in the refinement	0.1113
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
228955 (current)	2019-11-17	cif/ Updating files of 7229758, 7229759, 7229760 Original log message: Adding full bibliography for 7229758--7229760.cif.	7229760.cif
204301	2017-12-16	cif/ Adding structures of 7229758, 7229759, 7229760 via cif-deposit CGI script.	7229760.cif