Geometry & MOs

Info

ID:	371347
PubChem CID:	127345810
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	346.189257
ΔH_f, kcal/mol:	-129.87
Dipole, Da:	7.69
IP(EA), eV:	-8.78(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[2-(3-methoxyphenyl)acetyl]piperazin-1-yl]-2-(oxolan-3-yl)ethanone

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)N2CCCC2=O)NC(=O)CC3CCOC3

DOS

IR

Vibrations