EL9

Summary

Name:	cyclometalated-carbene platinum(II) complex
Formula:	C20 H15 F2 N4 Pt
Formal charge:	0
Formula weight:	544.435 Da
Component type:	non-polymer
Ambiguous Chemistry Warning:	The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution.

Chemical Descriptors

Type	Program	Version	Descriptor
InChI	InChI	1.03	InChI=1S/C11H6F2N.C9H10N3.Pt/c12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;1-11-6-7-12(8-11)9-4-2-3-5-10-9;/h1-4,6-7H;2-8H,1H3;
InChIKey	InChI	1.03	MSOPGFNQFJYXDN-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	CN1CN(C=C1)c2ccccn2.Fc3cc(F)c(c([Pt])c3)c4ccccn4
SMILES	CACTVS	3.385	CN1CN(C=C1)c2ccccn2.Fc3cc(F)c(c([Pt])c3)c4ccccn4
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	CN1C=CN2[C]1[Pt]3(c4cc(cc(c4C5=[N]3C=CC=C5)F)F)[N]6=C2C=CC=C6
SMILES	OpenEye OEToolkits	2.0.7	CN1C=CN2[C]1[Pt]3(c4cc(cc(c4C5=[N]3C=CC=C5)F)F)[N]6=C2C=CC=C6