Geometry & MOs

Info

ID:	149703
PubChem CID:	53789377
Reduced:	FN3O4C10H14 (1)
Stoich.:	AB3C4D10E14 (1)
Weight, g/mol:	367.178358
ΔH_f, kcal/mol:	-201.15
Dipole, Da:	5.32
IP(EA), eV:	-9.62(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dimethoxy-3-[phenyl(piperidin-1-yl)methyl]-3H-2-benzofuran-1-one

Drug info:

PubChemData

Smile

CO[C@]1([C@H](C[C@@H](O1)N2C=CC(=NC2=O)N)F)CO

DOS

IR

Vibrations