Geometry & MOs

Info

ID:	152332
PubChem CID:	56311246
Reduced:	O2N4C25H34 (1)
Stoich.:	A2B4C25D34 (1)
Weight, g/mol:	336.220164
ΔH_f, kcal/mol:	-53.75
Dipole, Da:	1.89
IP(EA), eV:	-8.06(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylphenyl)-1-[4-(1-phenylpropyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)NCCCN(C)C3=CC=CC=C3

DOS

IR

Vibrations