Crystallography Open Database

Information card for entry 4510444

Preview

Coordinates	4510444.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H23 Ag N6 O2
Calculated formula	C17 H23 Ag N6 O2
Title of publication	Silver(I)/Bipyrazole/Dicarboxylate Interpenetrated Coordination Networks: Spontaneous Chiral Resolution, Modulation of Topologies, Water Clusters, and Photoluminescences
Authors of publication	Han, Lu-Lu; Zhang, Xi-Ying; Chen, Jiang-Shan; Li, Zhong-Hui; Sun, Dao-Feng; Wang, Xing-Po; Sun, Di
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	5
Pages of publication	2230
a	23.1175 ± 0.0006 Å
b	23.1175 ± 0.0006 Å
c	28.1024 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	15018.5 ± 1 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	142
Hermann-Mauguin space group symbol	I 41/a c d :2
Hall space group symbol	-I 4bd 2c
Residual factor for all reflections	0.0433
Residual factor for significantly intense reflections	0.0307
Weighted residual factors for significantly intense reflections	0.0737
Weighted residual factors for all reflections included in the refinement	0.0816
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
179651 (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 4/51/04.	4510444.cif
115661	2014-06-05	cif/ Updating files of 4510442, 4510443, 4510444, 4510445, 4510446, 4510447, 4510448, 4510449 Original log message: Adding full bibliography for 4510442--4510449.cif.	4510444.cif
109582	2014-04-17	cif/ Adding structures of 4510442, 4510443, 4510444, 4510445, 4510446, 4510447, 4510448, 4510449 via cif-deposit CGI script.	4510444.cif