Geometry & MOs

Info

ID:	277966
PubChem CID:	103832260
Reduced:	SN3O3C14H17 (1)
Stoich.:	AB3C3D14E17 (1)
Weight, g/mol:	351.98925
ΔH_f, kcal/mol:	-63.12
Dipole, Da:	4.79
IP(EA), eV:	-9.2(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-fluoro-N-[(4S)-4-methoxypyrrolidin-3-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CO[C@H]1CNCC1NS(=O)(=O)C2=CC=CC3=C2C=CC=N3

DOS

IR

Vibrations