Geometry & MOs

Info

ID:	329876
PubChem CID:	127246743
Reduced:	SF2O2N3C16H17 (1)
Stoich.:	AB2C2D3E16F17 (1)
Weight, g/mol:	323.166748
ΔH_f, kcal/mol:	-116.36
Dipole, Da:	3.16
IP(EA), eV:	-8.73(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-cyclohexylsulfonylpyrrolidin-2-yl)-N-methylpyridin-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations