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Tris[2-(2,4-difluorophenyl)pyridine]iridium(III)

Catalog Number ACM387859703-3
CAS 387859-70-3
Structure Tris[2-(2,4-difluorophenyl)pyridine]iridium(III)
Synonyms 2-(2,4-Difluorobenzene-6-id-1-yl)pyridine;iridium(3+)
Molecular Weight 762.7
Molecular Formula C33H18F6IrN3
Canonical SMILES C1=CC=NC(=C1)C2=C(C=C(C=[C-]2)F)F.C1=CC=NC(=C1)C2=C(C=C(C=[C-]2)F)F.C1=CC=NC(=C1)C2=C(C=C(C=[C-]2)F)F.[Ir+3]
InChI InChI=1S/3C11H6F2N.Ir/c3*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;/h3*1-4,6-7H;/q3*-1;+3
InChI Key GJHHESUUYZNNGV-UHFFFAOYSA-N
Melting Point 401 °C
Purity 96%
Appearance Powder
Exact Mass 763.10342
Hydrogen Bond Acceptor Count 12
Hydrogen Bond Donor Count 0
Monoisotopic Mass 763.10342
Rotatable Bond Count 3
Topological Polar Surface Area 38.7 Ų

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