Geometry & MOs

Info

ID:	303264
PubChem CID:	124489432
Reduced:	SF2N2O2C12H16 (1)
Stoich.:	AB2C2D2E12F16 (1)
Weight, g/mol:	286.115127
ΔH_f, kcal/mol:	-149.55
Dipole, Da:	5.81
IP(EA), eV:	-9.13(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-1-(4-fluoro-2-methylphenyl)sulfonylpyrrolidin-3-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CNC[C@H]1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)F)F

DOS

IR

Vibrations