Crystallography Open Database

Information card for entry 7235258

Preview

Coordinates	7235258.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H38 Br2 Cl0.5 F9 Ir N4 P1.5
Calculated formula	C40 H38 Br2 Cl0.5 F9 Ir N4 P1.5
Title of publication	Iridium complex-linked porous organic polymers for recyclable, broad-scope photocatalysis of organic transformations
Authors of publication	Xu, Zi-Yue; Luo, Yi; Zhang, Dan-Wei; Wang, Hui; Sun, Xing-Wen; Li, Zhan-Ting
Journal of publication	Green Chemistry
Year of publication	2020
Journal volume	22
Journal issue	1
Pages of publication	136 - 143
a	11.3884 ± 0.0014 Å
b	14.5156 ± 0.0018 Å
c	14.8459 ± 0.0017 Å
α	90°
β	105.062 ± 0.005°
γ	90°
Cell volume	2369.9 ± 0.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0762
Residual factor for significantly intense reflections	0.0623
Weighted residual factors for significantly intense reflections	0.1864
Weighted residual factors for all reflections included in the refinement	0.2044
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	1.34138 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
257576 (current)	2020-10-06	cif/ Updating files of 7235257, 7235258, 7235259 Original log message: Adding full bibliography for 7235257--7235259.cif.	7235258.cif
247760	2020-02-04	cif/ Updating files of 7235257, 7235258, 7235259 Original log message: Adding full bibliography for 7235257--7235259.cif.	7235258.cif
232199	2019-11-23	cif/ Adding structures of 7235257, 7235258, 7235259 via cif-deposit CGI script.	7235258.cif