Geometry & MOs

Info

ID:	276908
PubChem CID:	103825689
Reduced:	SN2O3C14H22 (1)
Stoich.:	AB2C3D14E22 (1)
Weight, g/mol:	374.95985
ΔH_f, kcal/mol:	-119.5
Dipole, Da:	3.9
IP(EA), eV:	-9.56(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[(1S)-2-hydroxy-1-phenylethyl]-2-methylthiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)S(=O)(=O)N[C@H](CO)C2=CC=CC=C2

DOS

IR

Vibrations