Geometry & MOs

Info

ID:	251004
PubChem CID:	103100774
Reduced:	BrClNO2S2C12H17 (1)
Stoich.:	ABCD2E2F12G17 (1)
Weight, g/mol:	378.91031
ΔH_f, kcal/mol:	-75.35
Dipole, Da:	6.23
IP(EA), eV:	-9.49(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(bromomethyl)phenyl]-5-chloro-4-methylthiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NCC2CCCC2CBr)Cl

DOS

IR

Vibrations