Crystallography Open Database

Information card for entry 7206069

7206068 << 7206069 >> 7206070

Preview

Coordinates	7206069.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H17 N6 O4.5 Zn
Calculated formula	C26 H17 N6 O4.5 Zn
Title of publication	Correlation between the photoactive character and the structures of two novel metal organic frameworks
Authors of publication	Fu, Zhiyong; Chen, Yuan; Zhang, Jie; Liao, Shijun
Journal of publication	Journal of Materials Chemistry
Year of publication	2011
Journal volume	21
Journal issue	22
Pages of publication	7895
a	15.264 ± 0.003 Å
b	12.908 ± 0.003 Å
c	24.867 ± 0.005 Å
α	90°
β	99.4 ± 0.03°
γ	90°
Cell volume	4833.7 ± 1.8 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
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	0.0588
Residual factor for significantly intense reflections	0.0331
Weighted residual factors for significantly intense reflections	0.0781
Weighted residual factors for all reflections included in the refinement	0.0975
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7206069.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206069.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206069.cif
21416	2011-06-22	../uploads/cif-deposit/cod/cif Adding structures of 7206069, 7206070 via cif-deposit CGI script.	7206069.cif