Geometry & MOs

Info

ID:	171798
PubChem CID:	75428178
Reduced:	FON3C15H18 (1)
Stoich.:	ABC3D15E18 (1)
Weight, g/mol:	334.18567
ΔH_f, kcal/mol:	7.89
Dipole, Da:	1.12
IP(EA), eV:	-9.32(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[(dimethylamino)methyl]-4-fluorophenyl]methyl]-1-(3-fluoro-4-methoxyphenyl)ethanamine

Drug info:

PubChemData

Smile

CCN(CC1=NC(=NO1)C2=CC(=C(C=C2)F)C)C3CC3

DOS

IR

Vibrations