Geometry & MOs

Info

ID:

320234

PubChem CID:

126658874

Reduced:

FON3H18C19 (1)

Stoich.:

ABC3D18E19 (1)

Weight, g/mol:

373.15904

ΔHf, kcal/mol:

0.61

Dipole, Da:

2.55

IP(EA), eV:

-9.26(-0.53)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[[2-fluoro-4-(1-methylindazol-6-yl)phenyl]methyl]-1,3-dihydroisoindol-1-ol

Drug info:

PubChemData

Smile

CN1C(=CC=N1)C2=CC(=C(C=C2)CN3CC4=CC=CC=C4C3O)F

DOS

IR

Vibrations