Geometry & MOs

Info

ID:	204644
PubChem CID:	79992390
Reduced:	SO2C11H16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	296.94928
ΔH_f, kcal/mol:	-87.1
Dipole, Da:	0.43
IP(EA), eV:	-8.89(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-4-methylthiophen-2-yl)-2-methylsulfonylethanamine

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(C(C)C)C(=O)OC

DOS

IR

Vibrations