Geometry & MOs

Info

ID:	79844
PubChem CID:	49830791
Reduced:	N2S2O3H12C15 (1)
Stoich.:	A2B2C3D12E15 (1)
Weight, g/mol:	346.044585
ΔH_f, kcal/mol:	-49.83
Dipole, Da:	7.38
IP(EA), eV:	-9.41(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethylsulfonylphenyl)thieno[2,3-c]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=CC3=C2C=C(S3)C(=O)N

DOS

IR

Vibrations