Geometry & MOs

Info

ID:	159511
PubChem CID:	57288290
Reduced:	SO2N3C12H19 (1)
Stoich.:	AB2C3D12E19 (1)
Weight, g/mol:	494.232934
ΔH_f, kcal/mol:	-68.79
Dipole, Da:	8.13
IP(EA), eV:	-8.87(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-cyclohexyl-1-(3-fluorophenyl)-3-hydroxy-6-(hydroxyamino)-6-oxohexan-2-yl]quinoxaline-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCCCC1NS(=O)(=O)C2=CC=C(C=C2)N

DOS

IR

Vibrations