Geometry & MOs

Info

ID:	341287
PubChem CID:	127263834
Reduced:	ClF3N3C7H9 (1)
Stoich.:	AB3C3D7E9 (1)
Weight, g/mol:	337.88184
ΔH_f, kcal/mol:	-156.5
Dipole, Da:	1.09
IP(EA), eV:	-10.96(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-iodo-4-(trifluoromethoxy)phenol

Drug info:

PubChemData

Smile

CC(C1=CN=C(N=C1)C(F)(F)F)N.Cl

DOS

IR

Vibrations