Geometry & MOs

Info

ID:	344915
PubChem CID:	127268675
Reduced:	ClSN3O4C16H22 (1)
Stoich.:	ABC3D4E16F22 (1)
Weight, g/mol:	371.122501
ΔH_f, kcal/mol:	-159.89
Dipole, Da:	3.35
IP(EA), eV:	-9.3(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2-phenylethyl)pyrrolidin-1-yl]sulfonylthiane 1,1-dioxide

Drug info:

PubChemData

Smile

C1CC(CN(C1)S(=O)(=O)CC2CCCO2)C(=O)NC3=NC=C(C=C3)Cl

DOS

IR

Vibrations