Geometry & MOs

Info

ID:	203540
PubChem CID:	79842831
Reduced:	BrFSN2O3C11H14 (1)
Stoich.:	ABCD2E3F11G14 (1)
Weight, g/mol:	357.058376
ΔH_f, kcal/mol:	-151.57
Dipole, Da:	9.09
IP(EA), eV:	-8.57(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloroethyl)-N,3,5-trimethyl-N-(2-methylsulfonylethyl)pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CN(CCS(=O)(=O)C)C(=O)C1=CC(=C(C=C1Br)F)N

DOS

IR

Vibrations