Geometry & MOs

Info

ID:	24141
PubChem CID:	608045
Reduced:	BrO2N3H8C12 (1)
Stoich.:	AB2C3D8E12 (1)
Weight, g/mol:	304.97999
ΔH_f, kcal/mol:	-3.8
Dipole, Da:	4.07
IP(EA), eV:	-9.42(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-bromo-1-methyl-5H-imidazo[4,5-c][1]benzazepine-4,10-dione

Drug info:

PubChemData

Smile

CN1C=NC2=C1C(=O)C3=C(C=CC(=C3)Br)NC2=O

DOS

IR

Vibrations