Geometry & MOs

Info

ID:	27503
PubChem CID:	821681
Reduced:	BrSO2C8H9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	199.030314
ΔH_f, kcal/mol:	-58.93
Dipole, Da:	2.98
IP(EA), eV:	-9.26(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-acetamidothiophene-3-carboxylate

Drug info:

PubChemData

Smile

C1COC(OC1)C2=C(C=CS2)Br

DOS

IR

Vibrations