Geometry & MOs

Info

ID:	396547
PubChem CID:	135028724
Reduced:	ON3H13C17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	299.98983
ΔH_f, kcal/mol:	48.39
Dipole, Da:	9.87
IP(EA), eV:	-8.85(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromophenyl)-3-iminoisoindol-1-one

Drug info:

PubChemData

Smile

CN1C=CC2=C(C=CC=C21)C3=NC(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations