Geometry & MOs

Info

ID:	303352
PubChem CID:	124489554
Reduced:	ClSN2O2F3C12H14 (1)
Stoich.:	ABC2D2E3F12G14 (1)
Weight, g/mol:	342.041661
ΔH_f, kcal/mol:	-222.03
Dipole, Da:	4.01
IP(EA), eV:	-9.35(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-methyl-N-[(3S)-pyrrolidin-3-yl]-3-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CN([C@@H]1CCNC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

DOS

IR

Vibrations