Geometry & MOs

Info

ID:	265046
PubChem CID:	103508025
Reduced:	SO2N4C13H20 (1)
Stoich.:	AB2C4D13E20 (1)
Weight, g/mol:	314.123504
ΔH_f, kcal/mol:	-79.62
Dipole, Da:	4.73
IP(EA), eV:	-8.48(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-ethyl-5-[(1-methylpyrrolidin-3-yl)amino]-4-methylsulfanylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)C1=C(C(=C(S1)NC2CCN(C2)C)C(=O)N)N

DOS

IR

Vibrations