Geometry & MOs

Info

ID:	422441
PubChem CID:	135117836
Reduced:	N3O4C24H25 (1)
Stoich.:	A3B4C24D25 (1)
Weight, g/mol:	363.215806
ΔH_f, kcal/mol:	-77.82
Dipole, Da:	6.0
IP(EA), eV:	-8.41(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]-5-[(4-methylpiperidin-1-yl)methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)CCOC23CCN(CC3)C(=O)C4=CC5=NC=CN=C5C=C4)OC

DOS

IR

Vibrations