Geometry & MOs

Info

ID:	267072
PubChem CID:	103580638
Reduced:	SO2Cl3N3H10C12 (1)
Stoich.:	AB2C3D3E10F12 (1)
Weight, g/mol:	410.87499
ΔH_f, kcal/mol:	-39.87
Dipole, Da:	5.68
IP(EA), eV:	-9.31(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-bromo-4-[(5-chloropyrazin-2-yl)sulfamoyl]thiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NC2=CN=C(C=N2)Cl)C)Cl

DOS

IR

Vibrations