Geometry & MOs

Info

ID:	27129
PubChem CID:	814755
Reduced:	ION2H9C12 (1)
Stoich.:	ABC2D9E12 (1)
Weight, g/mol:	322.131742
ΔH_f, kcal/mol:	35.09
Dipole, Da:	6.05
IP(EA), eV:	-9.56(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-4-(1,3-dioxoisoindol-2-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NC2=CC=NC=C2)I

DOS

IR

Vibrations