Crystallography Open Database

Information card for entry 7226517

Preview

Coordinates	7226517.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H18 N2 O8 Zn2
Calculated formula	C28 H18 N2 O8 Zn2
Title of publication	Cleavage of a C‒C σ bond between two phenyl groups under mild conditions during the construction of Zn(ii) organic frameworks
Authors of publication	Liu, Bo; Zhou, Hui-Fang; Guan, Zheng-Hui; Hou, Lei; Cui, Bin; Wang, Yao-Yu
Journal of publication	Green Chem.
Year of publication	2016
Journal volume	18
Journal issue	20
Pages of publication	5418
a	10.8088 ± 0.0015 Å
b	10.8088 ± 0.0015 Å
c	16.283 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	1902.3 ± 0.7 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	5
Space group number	123
Hermann-Mauguin space group symbol	P 4/m m m
Hall space group symbol	-P 4 2
Residual factor for all reflections	0.0968
Residual factor for significantly intense reflections	0.0863
Weighted residual factors for significantly intense reflections	0.2481
Weighted residual factors for all reflections included in the refinement	0.2583
Goodness-of-fit parameter for all reflections included in the refinement	1.145
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
188252 (current)	2016-11-08	cif/ Updating files of 7226516, 7226517 Original log message: Adding full bibliography for 7226516--7226517.cif.	7226517.cif
186502	2016-09-10	cif/ Adding structures of 7226516, 7226517 via cif-deposit CGI script.	7226517.cif