Geometry & MOs

Info

ID:	201519
PubChem CID:	79550228
Reduced:	N2S2O3C9H18 (1)
Stoich.:	A2B2C3D9E18 (1)
Weight, g/mol:	403.92669
ΔH_f, kcal/mol:	-141.03
Dipole, Da:	1.29
IP(EA), eV:	-8.76(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-chloro-N-(2-methyl-2-methylsulfonylpropyl)pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CC(C(=S)N)C(=O)NCC(C)(C)S(=O)(=O)C

DOS

IR

Vibrations