Geometry & MOs

Info

ID:	371413
PubChem CID:	127346286
Reduced:	N2O4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	317.173942
ΔH_f, kcal/mol:	-178.41
Dipole, Da:	2.72
IP(EA), eV:	-9.39(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-(oxolan-3-yl)acetyl]amino]phenyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

COCC(=O)N1CCN(CC1)C(=O)CC2CCOC2

DOS

IR

Vibrations