68526-85-2 Purity
95%
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Specification
The molecular formula is C30H24F12FeN6P2.
The molecular weight is 814.3 g/mol.
The synonyms include Tris(2,2-bipyridine)iron(ii)bis(hexafluorophosphate) iron(2+), 2-pyridin-2-ylpyridine, and dihexafluorophosphate.
The component compounds are Hexafluorophosphate, 2,2'-Bipyridine, and Iron.
The IUPAC name is iron(2+);2-pyridin-2-ylpyridine;dihexafluorophosphate.
The InChIKey is FTBIBFKOIGZIGA-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Fe+2].
The CAS number is 70811-29-9.
There are 20 hydrogen bond acceptor counts.
Yes, the compound is canonicalized.