Geometry & MOs

Info

ID:	75595
PubChem CID:	48423716
Reduced:	O3N5C22H29 (1)
Stoich.:	A3B5C22D29 (1)
Weight, g/mol:	332.221226
ΔH_f, kcal/mol:	-77.12
Dipole, Da:	2.52
IP(EA), eV:	-8.63(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[2-(4-methylpiperazin-1-yl)pyridin-4-yl]methyl]propanamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=NC=CC(=C2)CNC(=O)C(CC3=CC=CC=C3)NC(=O)OC

DOS

IR

Vibrations