Geometry & MOs

Info

ID:	415101
PubChem CID:	135088087
Reduced:	N4O4C17H24 (1)
Stoich.:	A4B4C17D24 (1)
Weight, g/mol:	338.174276
ΔH_f, kcal/mol:	-22.03
Dipole, Da:	7.78
IP(EA), eV:	-9.22(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-benzyl-5-oxopyrrolidin-3-yl)amino]-N-ethylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=NC=C(C=C1)C(=O)N2C[C@H]3CN([C@@H](C2)COC3)CC(=O)O

DOS

IR

Vibrations