Geometry & MOs

Info

ID:	251326
PubChem CID:	103103104
Reduced:	SCl2N2O2C10H12 (1)
Stoich.:	AB2C2D2E10F12 (1)
Weight, g/mol:	284.09277
ΔH_f, kcal/mol:	-57.14
Dipole, Da:	4.63
IP(EA), eV:	-9.22(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-acetyl-5-chloro-2-hydroxyphenyl)methyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)C1=C(SC(=C1)Cl)Cl)CC(=O)N

DOS

IR

Vibrations