Geometry & MOs

Info

ID:	293111
PubChem CID:	117374110
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	248.152478
ΔH_f, kcal/mol:	-73.06
Dipole, Da:	3.57
IP(EA), eV:	-9.31(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(2-hydroxypropyl)phenyl]-1-methylpiperazin-2-one

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1N2CCN(C(=O)C2)C)O

DOS

IR

Vibrations