Geometry & MOs

Info

ID:	151801
PubChem CID:	56310610
Reduced:	O2N3C27H29 (1)
Stoich.:	A2B3C27D29 (1)
Weight, g/mol:	382.225643
ΔH_f, kcal/mol:	-21.67
Dipole, Da:	3.89
IP(EA), eV:	-8.93(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC3=CC(=CC=C3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations