cyclopentane; iron(2+); N-(phenylmethyl)aniline; hexafluorophosphate

Systemtic Name: cyclopentane; iron(2+); N-(phenylmethyl)aniline; hexafluorophosphate Openeye Name: ferrous; N-benzylaniline; cyclopentane; hexafluorophosphate CAS Name: cyclopentane; iron(2+); N-(phenylmethyl)aniline; hexafluorophosphate IUPAC Name: N-benzylaniline; cyclopentane; iron(2+); hexafluorophosphate Traditional Name: ferrous; benzyl(phenyl)amine; cyclopentane; hexafluorophosphate Formula: C18H18F6FeNP+ MolecularWeight: 449.1514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+2]

InChI

InChI=1S/C13H13N.C5H5.F6P.Fe/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;1-2-4-5-3-1;1-7(2,3,4,5)6;/h1-10,14H,11H2;1-5H;;/q;;-1;+2