Geometry & MOs

Info

ID:	374444
PubChem CID:	131329585
Reduced:	OSF4H4C9 (1)
Stoich.:	ABC4D4E9 (1)
Weight, g/mol:	288.94083
ΔH_f, kcal/mol:	-212.43
Dipole, Da:	5.39
IP(EA), eV:	-9.43(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-bromo-1-methyl-3-oxo-2H-thieno[3,4-b]pyrrole-4-carboxylate

Drug info:

PubChemData

Smile

C1=C2C=C(SC2=CC(=C1F)C(F)(F)F)O

DOS

IR

Vibrations