Crystallography Open Database

Information card for entry 4502002

4502001 << 4502002 >> 4502003

Preview

Coordinates	4502002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H12 Ag N3 O3 S
Calculated formula	C12 H12 Ag N3 O3 S
Title of publication	Stepwise Synthesis of Charged and Neutral Two-Dimensional Networks via One-Dimensional Silver(I) Coordination Polymer Based on Bis(4-pyridylmethyl)sulfide
Authors of publication	Park, Ki-Min; Seo, Joobeom; Moon, Suk-Hee; Lee, Shim Sung
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	9
Pages of publication	4148
a	7.5728 ± 0.001 Å
b	8.0887 ± 0.001 Å
c	12.3471 ± 0.0015 Å
α	87.566 ± 0.003°
β	78.346 ± 0.002°
γ	70.194 ± 0.002°
Cell volume	696.63 ± 0.15 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0484
Residual factor for significantly intense reflections	0.0386
Weighted residual factors for significantly intense reflections	0.0957
Weighted residual factors for all reflections included in the refinement	0.1033
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
179551 (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 4/50/20.	4502002.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502002.cif
36199	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502002, 4502003, 4502004, 4502005 via cif-deposit CGI script.	4502002.cif