Crystallography Open Database

Information card for entry 4504560

Preview

Coordinates	4504560.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H12 Cl3 Co N4
Calculated formula	C10 H12 Cl3 Co N4
Title of publication	Polymorphism in an Ionic Pair 2-Aminopyridyl-CoIIComplex: Role of N−H···Cl Hydrogen Bonds and π···π Interactions in Tuning the Columnar Packing
Authors of publication	Zhang, Guoqi; Yang, Guoqiang; Wu, Nianzu; Ma, Jin Shi
Journal of publication	Crystal Growth & Design
Year of publication	2006
Journal volume	6
Journal issue	1
Pages of publication	229
a	8.0925 ± 0.0016 Å
b	9.17 ± 0.0018 Å
c	10.819 ± 0.002 Å
α	89.1 ± 0.03°
β	86.28 ± 0.03°
γ	64.01 ± 0.03°
Cell volume	720.1 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0558
Residual factor for significantly intense reflections	0.0439
Weighted residual factors for significantly intense reflections	0.1328
Weighted residual factors for all reflections included in the refinement	0.1436
Goodness-of-fit parameter for all reflections included in the refinement	1.019
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
179580 (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 4/50/45.	4504560.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4504560.cif
47415	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 4504559, 4504560 via cif-deposit CGI script.	4504560.cif