Geometry & MOs

Info

ID:	142264
PubChem CID:	53006669
Reduced:	ClSO2N4C16H23 (1)
Stoich.:	ABC2D4E16F23 (1)
Weight, g/mol:	369.162332
ΔH_f, kcal/mol:	-48.87
Dipole, Da:	5.53
IP(EA), eV:	-8.53(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[(1-propan-2-yl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)N1CCN=C1N2CCN(CC2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations