Geometry & MOs

Info

ID:	329824
PubChem CID:	127246691
Reduced:	SO2N3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	335.110376
ΔH_f, kcal/mol:	-25.76
Dipole, Da:	4.55
IP(EA), eV:	-8.66(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]-N-methylpyridin-2-amine

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations