Crystallography Open Database

Information card for entry 4510860

Preview

Coordinates	4510860.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20.25 H33 K N O6.88 Os
Calculated formula	C20.25 H33 K N O6.875 Os
Title of publication	Os(VI)O2/K Metal‒Organic Frameworks: Infinite Chain, Grid, and Porous Networks
Authors of publication	Eckshtain-Levi, Meital; Yufit, Dmitry; Shimon, Linda J. W.; Kirillov, Alexander M.; Benisvy, Laurent
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	6
Pages of publication	2703
a	34.5483 ± 0.0015 Å
b	10.6845 ± 0.0005 Å
c	27.5819 ± 0.0011 Å
α	90°
β	107.569 ± 0.002°
γ	90°
Cell volume	9706.4 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.15 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	0.0341
Residual factor for significantly intense reflections	0.0257
Weighted residual factors for significantly intense reflections	0.0537
Weighted residual factors for all reflections included in the refinement	0.0563
Goodness-of-fit parameter for all reflections included in the refinement	1.019
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
179655 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/08.	4510860.cif
119064	2014-07-05	cif/ Updating files of 4510860, 4510861, 4510862 Original log message: Adding full bibliography for 4510860--4510862.cif.	4510860.cif
113744	2014-05-14	cif/ Adding structures of 4510860, 4510861, 4510862 via cif-deposit CGI script.	4510860.cif