Crystallography Open Database

Information card for entry 4108265

Preview

Coordinates	4108265.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	MOP-15
Formula	C358 H578 Cu24 N74 O185
Calculated formula	C344 H428 Cu24 N76 O168
Title of publication	Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra
Authors of publication	Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	11650 - 11661
a	31.2356 ± 0.0014 Å
b	31.2356 ± 0.0014 Å
c	30.617 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	29872 ± 3 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.0863
Residual factor for significantly intense reflections	0.065
Weighted residual factors for significantly intense reflections	0.1829
Weighted residual factors for all reflections included in the refinement	0.1932
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
178828 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/82.	4108265.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4108265.cif
56618	2012-05-14	cif/ Adding structures of 4108265 via cif-deposit CGI script.	4108265.cif