Geometry & MOs

Info

ID:	204992
PubChem CID:	80040694
Reduced:	FSC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	431.86291
ΔH_f, kcal/mol:	-93.06
Dipole, Da:	1.97
IP(EA), eV:	-8.84(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-[bromo-[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-5-methylthiophene

Drug info:

PubChemData

Smile

CC(C)C(CS)CSC1=C(C=C(C=C1)F)F

DOS

IR

Vibrations