Geometry & MOs

Info

ID:	195763
PubChem CID:	78732355
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	409.163771
ΔH_f, kcal/mol:	-130.26
Dipole, Da:	9.2
IP(EA), eV:	-8.86(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(1,3-benzodioxol-5-yl)ethylideneamino]oxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)N1CCCC(C1)C(=O)NCC2=CC=C(C=C2)N3CCCC3=O

DOS

IR

Vibrations