Crystallography Open Database

Information card for entry 4129282

Preview

Coordinates	4129282.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C264 H168 Cl3 Fe3 N12 O32 Zr6
Calculated formula	C264 H168 Cl3 Fe3 N12 O32 Zr6
Title of publication	New heterometallic zirconium metalloporphyrin frameworks and their heteroatom-activated high-surface-area carbon derivatives.
Authors of publication	Lin, Qipu; Bu, Xianhui; Kong, Aiguo; Mao, Chengyu; Zhao, Xiang; Bu, Fei; Feng, Pingyun
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	6
Pages of publication	2235 - 2238
a	25.4287 ± 0.0002 Å
b	25.4287 ± 0.0002 Å
c	25.4287 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	16442.7 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	221
Hermann-Mauguin space group symbol	P m -3 m
Hall space group symbol	-P 4 2 3
Residual factor for all reflections	0.1024
Residual factor for significantly intense reflections	0.087
Weighted residual factors for significantly intense reflections	0.2466
Weighted residual factors for all reflections included in the refinement	0.2713
Goodness-of-fit parameter for all reflections included in the refinement	1.061
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
240034 (current)	2019-11-25	cif/ Adding structures of 4129279, 4129280, 4129281, 4129282 via cif-deposit CGI script.	4129282.cif