Geometry & MOs

Info

ID:	425386
PubChem CID:	135126159
Reduced:	ClSF2O3N4H17C18 (1)
Stoich.:	ABC2D3E4F17G18 (1)
Weight, g/mol:	441.108245
ΔH_f, kcal/mol:	-142.07
Dipole, Da:	7.9
IP(EA), eV:	-9.34(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2,3-difluoro-5-[2-fluoro-2-(5-methoxypyrazin-2-yl)ethenyl]phenyl]-2,5-dimethyl-1,1-dioxo-6H-1,2,4-thiadiazin-3-amine

Drug info:

PubChemData

Smile

CC1(CS(=O)(=O)N(C(=N1)N)C)C2=C(C=CC(=C2)C=C(C3=CC(=O)C(=CN3)Cl)F)F

DOS

IR

Vibrations