Geometry & MOs

Info

ID:	55700
PubChem CID:	17395862
Reduced:	Cl2O2N3C17H21 (1)
Stoich.:	A2B2C3D17E21 (1)
Weight, g/mol:	340.142307
ΔH_f, kcal/mol:	-89.18
Dipole, Da:	4.68
IP(EA), eV:	-9.3(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2,3-dimethoxyphenyl)methyl-methylamino]methyl]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CN(CC1=C(C(=CC=C1)Cl)Cl)CN2C(=O)C3(CCCCC3)NC2=O

DOS

IR

Vibrations