Geometry & MOs

Info

ID:	39878
PubChem CID:	8142666
Reduced:	FSN3O3C21H26 (1)
Stoich.:	ABC3D3E21F26 (1)
Weight, g/mol:	367.225977
ΔH_f, kcal/mol:	-126.67
Dipole, Da:	2.34
IP(EA), eV:	-9.03(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[methyl-[(4-methylphenyl)methyl]amino]ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN(C)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

DOS

IR

Vibrations