Geometry & MOs

Info

ID:	330678
PubChem CID:	127248085
Reduced:	FSN2O3C15H23 (1)
Stoich.:	ABC2D3E15F23 (1)
Weight, g/mol:	344.156992
ΔH_f, kcal/mol:	-165.93
Dipole, Da:	5.08
IP(EA), eV:	-8.96(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-fluorophenyl)methyl-methylamino]methyl]-1-propylsulfonylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(C1)(CN(C)CC2=CC=C(C=C2)F)O

DOS

IR

Vibrations