Geometry & MOs

Info

ID:	185462
PubChem CID:	77302190
Reduced:	ClSN2O2C19H27 (1)
Stoich.:	ABC2D2E19F27 (1)
Weight, g/mol:	380.078383
ΔH_f, kcal/mol:	-93.04
Dipole, Da:	8.2
IP(EA), eV:	-9.43(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-6-methyl-5-[5-[(thiophen-2-ylmethylamino)methyl]thiophen-2-yl]-3H-pyridin-2-one;hydrochloride

Drug info:

PubChemData

Smile

CCC1C=C(C(=NC1=O)C)C2=CC=C(S2)CNC3CCC(CC3)O.Cl

DOS

IR

Vibrations