Geometry & MOs

Info

ID:	374085
PubChem CID:	131323566
Reduced:	BrHON2F4C7 (1)
Stoich.:	ABCD2E4F7 (1)
Weight, g/mol:	362.85673
ΔH_f, kcal/mol:	-180.74
Dipole, Da:	4.2
IP(EA), eV:	-10.95(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-(difluoromethoxy)-2-iodoaniline

Drug info:

PubChemData

Smile

C1=C(C(=C(N=C1Br)F)C#N)OC(F)(F)F

DOS

IR

Vibrations