Crystallography Open Database

Information card for entry 8103070

Preview

Coordinates	8103070.cif

Structure parameters

Chemical name	(Bis(2-pyridyl)imido)chloroplatinum(II)
Formula	C12 H8 Cl N3 O2 Pt
Calculated formula	C12 H8 Cl N3 O2 Pt
SMILES	[Pt]12(Cl)N(C(=O)c3[n]1cccc3)C(=O)c1[n]2cccc1
Title of publication	Crystal structure of (bis(2-pyridyl)imido)chloroplatinum(II), PtCl(C12H8N3O2)
Authors of publication	Kwang Ha
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2011
Journal volume	226
Journal issue	1
Pages of publication	55
a	14.1952 ± 0.0007 Å
b	7.4719 ± 0.0004 Å
c	22.6302 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	2400.3 ± 0.2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0777
Residual factor for significantly intense reflections	0.0336
Weighted residual factors for significantly intense reflections	0.0596
Weighted residual factors for all reflections included in the refinement	0.0789
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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.	8103070.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8103070.cif
28968	2011-11-02	../uploads/cif-deposit/cod/cif Adding structures of 8103070 via cif-deposit CGI script.	8103070.cif