Geometry & MOs

Info

ID:	396158
PubChem CID:	135027552
Reduced:	BrN2O3H11C16 (1)
Stoich.:	AB2C3D11E16 (1)
Weight, g/mol:	354.085186
ΔH_f, kcal/mol:	-35.65
Dipole, Da:	2.51
IP(EA), eV:	-9.66(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[acetyl-(1,3-dioxoisoindol-2-yl)amino]-2-methoxybenzoic acid

Drug info:

PubChemData

Smile

CC(=O)N(C1=CC=C(C=C1)Br)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations