Geometry & MOs

Info

ID:	424206
PubChem CID:	135121737
Reduced:	Cl2N2C9H14 (1)
Stoich.:	A2B2C9D14 (1)
Weight, g/mol:	277.8874
ΔH_f, kcal/mol:	-42.05
Dipole, Da:	5.89
IP(EA), eV:	-9.22(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-iodo-2-(trifluoromethyl)thiophene

Drug info:

PubChemData

Smile

CN1CC2=CC=CC=C2C1N.Cl.Cl

DOS

IR

Vibrations