Organofluorine / Alfa Chemistry
Iridium(1+), (2,2 inverted exclamation marka-bipyridine-|EN1,|EN1 inverted exclamation marka)bis[5-fluoro-2-(5-methyl-2-pyridinyl-|EN)phenyl-|EC]-, (OC-6-33)-, hexafluorophosphate(1-)

Iridium(1+), (2,2 inverted exclamation marka-bipyridine-|EN1,|EN1 inverted exclamation marka)bis[5-fluoro-2-(5-methyl-2-pyridinyl-|EN)phenyl-|EC]-, (OC-6-33)-, hexafluorophosphate(1-)

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Iridium(1+), (2,2 inverted exclamation marka-bipyridine-|EN1,|EN1 inverted exclamation marka)bis[5-fluoro-2-(5-methyl-2-pyridinyl-|EN)phenyl-|EC]-, (OC-6-33)-, hexafluorophosphate(1-)
Catalog OFC855523545-1
CAS 855523-54-5
Category Fluorinated Catalysts
Synonyms Iridium(1+), (2,2 inverted exclamation marka-bipyridine-|EN1,|EN1 inverted exclamation marka)bis[5-fluoro-2-(5-methyl-2-pyridinyl-|EN)phenyl-|EC]-, (OC-6-33)-, hexafluorophosphate(1-)
Purity 95%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 2-(4-fluorobenzene-6-id-1-yl)-5-methylpyridine;iridium(3+);2-pyridin-2-ylpyridine;hexafluorophosphate
InChI InChI=1S/2C12H9FN.C10H8N2.F6P.Ir/c2*1-9-2-7-12(14-8-9)10-3-5-11(13)6-4-10;1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-7(2,3,4,5)6;/h2*2-3,5-8H,1H3;1-8H;;/q2*-1;;-1;+3
InChI Key FRXNGJIEFWXINI-UHFFFAOYSA-N
Isomeric SMILES CC1=CN=C(C=C1)C2=[C-]C=C(C=C2)F.CC1=CN=C(C=C1)C2=[C-]C=C(C=C2)F.C1=CC=NC(=C1)C2=CC=CC=N2.F[P-](F)(F)(F)(F)F.[Ir+3]
Molecular Formula C34H26F8IrN4P
Molecular Weight 865.78
Storage Keep in dark place, inert atmosphere, room temperature
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 0
Exact Mass 866.13966 g/mol
Monoisotopic Mass 866.13966 g/mol
Topological Polar Surface Area 51.6Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 970

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