Geometry & MOs

Info

ID:	264033
PubChem CID:	103419742
Reduced:	SO2N3C11H17 (1)
Stoich.:	AB2C3D11E17 (1)
Weight, g/mol:	319.081305
ΔH_f, kcal/mol:	-76.82
Dipole, Da:	3.39
IP(EA), eV:	-8.2(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-cyclopropyl-5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCO1)C2=CC(=C(S2)C(=O)NC)N

DOS

IR

Vibrations