Crystallography Open Database

Information card for entry 1512880

Preview

Coordinates	1512880.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H29 Ag N4 O2
Calculated formula	C35 H29 Ag N4 O2
Title of publication	Synthesis and biological evaluation of <i>N</i>-heterocyclic carbene-silver(I) acetate complexes derived from 4,5-ditolyl-imidazole
Authors of publication	Frauke Hackenberg; Grainne Lally; Helge Müller-Bunz; Francesca Paradisi; Daniela Quaglia; Wojciech Streciwilk; Matthias Tacke
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	395
Pages of publication	135 - 144
a	7.8609 ± 0.0001 Å
b	16.581 ± 0.0003 Å
c	23.7243 ± 0.0004 Å
α	89.668 ± 0.002°
β	89.978 ± 0.001°
γ	89.995 ± 0.001°
Cell volume	3092.21 ± 0.09 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0294
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0542
Weighted residual factors for all reflections included in the refinement	0.0561
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512880.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512880.cif
91041	2013-12-03	cif/ Adding structures of 1512880 via cif-deposit CGI script.	1512880.cif