Crystallography Open Database

Information card for entry 4506705

Preview

Coordinates	4506705.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H10 Ag3 N O3
Calculated formula	C16 H10 Ag3 N O3
Title of publication	Argentophilic Infinite Chain, Column, and Layer Structures Assembled with the Multinuclear Silver(I)‒Phenylethynide Supramolecular Synthon
Authors of publication	Cheng, Ping-Shing; Marivel, Samipillai; Zang, Shuang-Quan; Gao, Guang-Gang; Mak, Thomas C. W.
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	9
Pages of publication	4519
a	16.9178 ± 0.0006 Å
b	6.5132 ± 0.0002 Å
c	13.6048 ± 0.0005 Å
α	90°
β	92.956 ± 0.001°
γ	90°
Cell volume	1497.1 ± 0.09 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0239
Residual factor for significantly intense reflections	0.0226
Weighted residual factors for significantly intense reflections	0.0551
Weighted residual factors for all reflections included in the refinement	0.0562
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
179603 (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 4/50/67.	4506705.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4506705.cif
71770	2013-01-21	cif/ Adding structures of 4506704, 4506705, 4506706, 4506707, 4506708, 4506709, 4506710, 4506711, 4506712 via cif-deposit CGI script.	4506705.cif