Geometry & MOs

Info

ID:	196235
PubChem CID:	78800313
Reduced:	ClSN2O4C14H21 (1)
Stoich.:	ABC2D4E14F21 (1)
Weight, g/mol:	332.119464
ΔH_f, kcal/mol:	-171.79
Dipole, Da:	6.69
IP(EA), eV:	-9.61(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-hydroxypropylamino)-1-oxo-3-phenylpropan-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NCC(C)O)Cl

DOS

IR

Vibrations