Geometry & MOs

Info

ID:	75465
PubChem CID:	48423507
Reduced:	N4O4C19H28 (1)
Stoich.:	A4B4C19D28 (1)
Weight, g/mol:	297.205242
ΔH_f, kcal/mol:	-164.17
Dipole, Da:	5.29
IP(EA), eV:	-8.81(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-acetylpiperazin-1-yl)ethyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)CCNC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations