Crystallography Open Database

Information card for entry 8103220

Preview

Coordinates	8103220.cif

Structure parameters

Chemical name	Dichloro(2-pyridinealdoxime-κ^2^N,N')palladium(II)
Formula	C6 H6 Cl2 N2 O Pd
Calculated formula	C6 H6 Cl2 N2 O Pd
SMILES	[Pd]1([N](O)=Cc2[n]1cccc2)(Cl)Cl
Title of publication	Crystal structure of dichloro(2-pyridinealdoxime-?2N,N')palladium(II), PdCl2(C6H6N2O)
Authors of publication	Kwang Ha
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2011
Journal volume	226
Journal issue	4
Pages of publication	525
a	6.1726 ± 0.0007 Å
b	15.9478 ± 0.0018 Å
c	9.1145 ± 0.001 Å
α	90°
β	100.506 ± 0.002°
γ	90°
Cell volume	882.18 ± 0.17 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
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	0.0758
Residual factor for significantly intense reflections	0.0374
Weighted residual factors for significantly intense reflections	0.0752
Weighted residual factors for all reflections included in the refinement	0.0987
Goodness-of-fit parameter for all reflections included in the refinement	1.014
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
176728 (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 8.	8103220.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8103220.cif
32562	2012-02-09	../uploads/cif-deposit/cod/cif Adding structures of 8103220 via cif-deposit CGI script.	8103220.cif