Geometry & MOs

Info

ID:	303354
PubChem CID:	124489557
Reduced:	ClSN2O2F3C12H14 (1)
Stoich.:	ABC2D2E3F12G14 (1)
Weight, g/mol:	342.041661
ΔH_f, kcal/mol:	-220.34
Dipole, Da:	5.69
IP(EA), eV:	-9.23(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-methyl-N-[(3S)-pyrrolidin-3-yl]-2-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations