Geometry & MOs

Info

ID:	75532
PubChem CID:	48423613
Reduced:	O3N4C20H32 (1)
Stoich.:	A3B4C20D32 (1)
Weight, g/mol:	297.241627
ΔH_f, kcal/mol:	-125.09
Dipole, Da:	3.61
IP(EA), eV:	-8.39(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[2-(4-ethylpiperazin-1-yl)propyl]propanamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C(C)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations