Geometry & MOs

Info

ID:	265094
PubChem CID:	103510044
Reduced:	SO2N3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	303.071134
ΔH_f, kcal/mol:	-24.66
Dipole, Da:	5.31
IP(EA), eV:	-8.41(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-ethylsulfonyl-N-methyl-5-(prop-2-enylamino)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(SC(=C1N)C(=O)NC2CC2)NCC=C

DOS

IR

Vibrations