Geometry & MOs

Info

ID:	264996
PubChem CID:	103506714
Reduced:	SN2O3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	331.102434
ΔH_f, kcal/mol:	-139.84
Dipole, Da:	6.45
IP(EA), eV:	-8.2(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-4-ethylsulfonylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CC1C)C2=C(C(=C(S2)C(=O)C)N)C(=O)OC

DOS

IR

Vibrations