Crystallography Open Database

Information card for entry 4321089

Preview

Coordinates	4321089.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Ag(dmb)2 DCTC
Formula	C70 H80 Ag2 N14 O2
Calculated formula	C70 H80 Ag2 N14 O2
Title of publication	Preparation and Characterization of {[M(dmb)2]TCNQ.xTCNQ° }n Polymers (M = Cu,Ag; dmb = 1,8-Diisocyano-p-menthane; x = 0, 0.5, 1.0, 1.5; TCNQ = 7,7,8,8-Tetracyano-p-quinodimethane) and Design of New Semi- and Photoconducting Organometallic Materials
Authors of publication	Daniel Fortin; Marc Drouin; Pierre D. Harvey
Journal of publication	Inorganic Chemistry
Year of publication	2000
Journal volume	39
Pages of publication	2758 - 2769
a	26.273 ± 0.003 Å
b	9.73 ± 0.003 Å
c	31.526 ± 0.003 Å
α	90°
β	112.12 ± 0.02°
γ	90°
Cell volume	7466 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.2301
Residual factor for significantly intense reflections	0.1346
Weighted residual factors for significantly intense reflections	0.2999
Weighted residual factors for all reflections included in the refinement	0.3243
Goodness-of-fit parameter for all reflections included in the refinement	1.473
Diffraction radiation wavelength	1.5406 Å
Diffraction radiation type	CuKa
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179313 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/10.	4321089.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4321089.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4321089.cif
18436	2011-04-29	../uploads/cif-deposit/cod/cif Adding structures of 4321089 via cif-deposit CGI script.	4321089.cif