Geometry & MOs

Info

ID:	396098
PubChem CID:	135027381
Reduced:	PSN3O3C15H18 (1)
Stoich.:	ABC3D3E15F18 (1)
Weight, g/mol:	371.026027
ΔH_f, kcal/mol:	-93.18
Dipole, Da:	6.4
IP(EA), eV:	-9.14(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-chlorophenyl)-5-diethoxyphosphoryl-[1,3]thiazolo[3,2-b][1,2,4]triazole

Drug info:

PubChemData

Smile

CCOP(=O)(C1=C(N2C(=NC=N2)S1)C3=CC=CC=C3C)OCC

DOS

IR

Vibrations