Crystallography Open Database

Information card for entry 4331827

Preview

Coordinates	4331827.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H37 Ag Cl N11 O4
Calculated formula	C30 H37 Ag Cl N11 O4
SMILES	c12cccc3CN(CCCN(Cc4cccc(CN(CCCN(C1)CC#N)CC#N)[n]4[Ag][n]23)CC#N)CC#N.Cl(=O)(=O)(=O)[O-].C(#N)C
Title of publication	Different Nuclearity Silver(I) Complexes with Novel Tetracyano Pendant-Armed Hexaazamacrocyclic Ligands
Authors of publication	del Carmen Fernández-Fernández, María; Bastida, Rufina; Macías, Alejandro; Pérez-Lourido, Paulo; Valencia, Laura
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	5
Pages of publication	2266 - 2275
a	18.1456 ± 0.0016 Å
b	10.2963 ± 0.0009 Å
c	19.6626 ± 0.0017 Å
α	90°
β	111.432 ± 0.002°
γ	90°
Cell volume	3419.6 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0519
Residual factor for significantly intense reflections	0.0357
Weighted residual factors for significantly intense reflections	0.0638
Weighted residual factors for all reflections included in the refinement	0.0676
Goodness-of-fit parameter for all reflections included in the refinement	0.857
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
179421 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/18.	4331827.cif
97926	2014-01-29	cif/ Adding structures of 4331825, 4331826, 4331827, 4331828 via cif-deposit CGI script.	4331827.cif