Geometry & MOs

Info

ID:	22877
PubChem CID:	599350
Reduced:	N3O4H19C20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	365.137556
ΔH_f, kcal/mol:	-75.71
Dipole, Da:	4.55
IP(EA), eV:	-8.45(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethylideneamino)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NN=CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations