Crystallography Open Database

Information card for entry 4500335

Preview

Coordinates	4500335.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H6 Ag N3
Calculated formula	C4 H6 Ag N3
Title of publication	Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies
Authors of publication	Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	3
Pages of publication	796
a	7.1495 ± 0.0004 Å
b	8.1326 ± 0.0004 Å
c	9.5939 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	557.83 ± 0.05 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	4
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0119
Residual factor for significantly intense reflections	0.0119
Weighted residual factors for significantly intense reflections	0.0302
Weighted residual factors for all reflections included in the refinement	0.0302
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
179534 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/03.	4500335.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500335.cif
34456	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500334, 4500335, 4500336, 4500337, 4500338, 4500339, 4500340 via cif-deposit CGI script.	4500335.cif