Geometry & MOs

Info

ID:	265081
PubChem CID:	103509617
Reduced:	N2S2O4C13H20 (1)
Stoich.:	A2B2C4D13E20 (1)
Weight, g/mol:	267.104148
ΔH_f, kcal/mol:	-154.11
Dipole, Da:	5.42
IP(EA), eV:	-8.41(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-acetyl-4-amino-2-(3-methylpyrrolidin-1-yl)thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)C1=C(SC(=C1N)C(=O)OC)N(C)CC2CC2

DOS

IR

Vibrations