Geometry & MOs

Info

ID:	259721
PubChem CID:	103172957
Reduced:	SO3C15H16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	299.94558
ΔH_f, kcal/mol:	-86.33
Dipole, Da:	4.97
IP(EA), eV:	-8.66(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(3-bromofuran-2-yl)-4-methylthiophene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C2=C(SC=C2C)C(=O)OC

DOS

IR

Vibrations