Geometry & MOs

Info

ID:	74561
PubChem CID:	48422088
Reduced:	N3O3C22H31 (1)
Stoich.:	A3B3C22D31 (1)
Weight, g/mol:	283.225977
ΔH_f, kcal/mol:	-74.11
Dipole, Da:	7.1
IP(EA), eV:	-8.93(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[3-(4-methylpiperazin-1-yl)propyl]propanamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CN(CCCN2C=CN=C2)C(=O)C(C)OCC3CC3

DOS

IR

Vibrations