Crystallography Open Database

Information card for entry 4121238

Preview

Coordinates	4121238.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H34 O17 Zn4
Calculated formula	C51 H34 O17 Zn4
Title of publication	Programmed Pore Architectures in Modular Quaternary Metal-Organic Frameworks
Authors of publication	Lujia Liu; Kristina Konstas; Matthew R. Hill; Shane G. Telfer
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	17731 - 17734
a	60.3052 ± 0.0011 Å
b	60.3052 ± 0.0011 Å
c	60.3052 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	219313 ± 7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	220
Hermann-Mauguin space group symbol	I -4 3 d
Hall space group symbol	I -4bd 2c 3
Residual factor for all reflections	0.1404
Residual factor for significantly intense reflections	0.1063
Weighted residual factors for significantly intense reflections	0.3041
Weighted residual factors for all reflections included in the refinement	0.3269
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4121238.html