Crystallography Open Database

Information card for entry 4128108

Preview

Coordinates	4128108.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C288 H192 N36 O72 Ru6 Zr6
Calculated formula	C288 H192 N36 O72 Ru6 Zr6
Title of publication	Metal-Organic Framework Photocatalyst Incorporating Bis(4'-(4-carboxyphenyl)-terpyridine)ruthenium(II) for Visible-Light-Driven Carbon Dioxide Reduction.
Authors of publication	Elcheikh Mahmoud, Mahmoud; Audi, Hassib; Assoud, Abdeljalil; Ghaddar, Tarek H.; Hmadeh, Mohamad
Journal of publication	Journal of the American Chemical Society
Year of publication	2019
Journal volume	141
Journal issue	17
Pages of publication	7115 - 7121
a	52.5621 ± 0.0008 Å
b	23.1563 ± 0.0004 Å
c	23.8286 ± 0.0004 Å
α	90°
β	95.335 ± 0.001°
γ	90°
Cell volume	28877.2 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.2229
Residual factor for significantly intense reflections	0.0725
Weighted residual factors for significantly intense reflections	0.1558
Weighted residual factors for all reflections included in the refinement	0.1791
Goodness-of-fit parameter for all reflections included in the refinement	1.022
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
221238 (current)	2019-11-03	cif/ Adding structures of 4128108 via cif-deposit CGI script.	4128108.cif