Geometry & MOs

Info

ID:	125572
PubChem CID:	50928800
Reduced:	ClFN3O4H15C19 (1)
Stoich.:	ABC3D4E15F19 (1)
Weight, g/mol:	397.109627
ΔH_f, kcal/mol:	-136.44
Dipole, Da:	8.73
IP(EA), eV:	-8.92(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-methoxyphenyl)-2,3-dioxopyrazin-1-yl]-N-(3-methylsulfanylphenyl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2C=CN(C(=O)C2=O)CC(=O)NC3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations