Geometry & MOs

Info

ID:	18008
PubChem CID:	532780
Reduced:	ClSO2H7C11 (1)
Stoich.:	ABC2D7E11 (1)
Weight, g/mol:	237.985528
ΔH_f, kcal/mol:	-31.23
Dipole, Da:	4.16
IP(EA), eV:	-9.28(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl) thiophene-2-carboxylate

Drug info:

PubChemData

Smile

C1=CSC(=C1)C(=O)OC2=CC=C(C=C2)Cl

DOS

IR

Vibrations