Geometry & MOs

Info

ID:	288968
PubChem CID:	104329130
Reduced:	FSBr3H8C12 (1)
Stoich.:	ABC3D8E12 (1)
Weight, g/mol:	441.78604
ΔH_f, kcal/mol:	12.83
Dipole, Da:	2.19
IP(EA), eV:	-9.58(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dibromo-5-[bromo-(4-fluoro-2-methylphenyl)methyl]thiophene

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(C2=C(SC(=C2)Br)Br)Br

DOS

IR

Vibrations