Geometry & MOs

Info

ID:	21429
PubChem CID:	588192
Reduced:	SO2C7H8 (1)
Stoich.:	AB2C7D8 (1)
Weight, g/mol:	156.024501
ΔH_f, kcal/mol:	-69.53
Dipole, Da:	6.52
IP(EA), eV:	-9.74(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethylthiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)C(=O)O

DOS

IR

Vibrations