Geometry & MOs

Info

ID:	275414
PubChem CID:	103815828
Reduced:	NC8H13 (2)
Stoich.:	AB8C13 (2)
Weight, g/mol:	256.189926
ΔH_f, kcal/mol:	2.38
Dipole, Da:	2.11
IP(EA), eV:	-8.72(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-[methyl-(1-oxo-1-piperazin-1-ylpropan-2-yl)amino]propanamide

Drug info:

PubChemData

Smile

CC(CN(C)CC1CCCNC1)C2=CC=CC=C2

DOS

IR

Vibrations