Geometry & MOs

Info

ID:	340938
PubChem CID:	127263373
Reduced:	BrO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	350.83226
ΔH_f, kcal/mol:	-75.78
Dipole, Da:	2.21
IP(EA), eV:	-9.71(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-fluoro-2-iodoaniline;hydrochloride

Drug info:

PubChemData

Smile

C1C(CC(=O)CC1O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations