Geometry & MOs

Info

ID:	23354
PubChem CID:	603185
Reduced:	BrON2H13C16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	328.02113
ΔH_f, kcal/mol:	37.96
Dipole, Da:	4.52
IP(EA), eV:	-9.03(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(2,3-dihydroinden-1-ylideneamino)benzamide

Drug info:

PubChemData

Smile

C1CC(=NNC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C31

DOS

IR

Vibrations