Geometry & MOs

Info

ID:	371406
PubChem CID:	127346276
Reduced:	O2N4C17H26 (1)
Stoich.:	A2B4C17D26 (1)
Weight, g/mol:	332.221226
ΔH_f, kcal/mol:	-62.79
Dipole, Da:	4.76
IP(EA), eV:	-8.61(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]methyl]-2-(oxolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=NC=CC(=C2)CNC(=O)CC3CCOC3

DOS

IR

Vibrations