Geometry & MOs

Info

ID:	242732
PubChem CID:	99205893
Reduced:	SO2N4C19H34 (1)
Stoich.:	AB2C4D19E34 (1)
Weight, g/mol:	436.94248
ΔH_f, kcal/mol:	-81.71
Dipole, Da:	5.07
IP(EA), eV:	-7.96(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(5-ethylthiophen-2-yl)methyl]-5-methylsulfonylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2CCN(CC2)CC[C@H](C)NS(=O)(=O)N(C)C(C)C

DOS

IR

Vibrations