Geometry & MOs

Info

ID:	278231
PubChem CID:	103834225
Reduced:	NS2O5C12H17 (1)
Stoich.:	AB2C5D12E17 (1)
Weight, g/mol:	386.95985
ΔH_f, kcal/mol:	-197.35
Dipole, Da:	2.8
IP(EA), eV:	-9.53(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methylthiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CCS(=O)(=O)N[C@@H]1[C@@H](CC2=CC=CC=C12)O

DOS

IR

Vibrations