Geometry & MOs

Info

ID:	396097
PubChem CID:	135027380
Reduced:	F2O3C14H14 (1)
Stoich.:	A2B3C14D14 (1)
Weight, g/mol:	351.08065
ΔH_f, kcal/mol:	-210.83
Dipole, Da:	3.68
IP(EA), eV:	-10.02(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@@]1(CC2=C(C1=O)C=C(C=C2)F)F

DOS

IR

Vibrations