Geometry & MOs

Info

ID:	321408
PubChem CID:	126665966
Reduced:	SF3O3N5H26C30 (1)
Stoich.:	AB3C3D5E26F30 (1)
Weight, g/mol:	389.193712
ΔH_f, kcal/mol:	-105.96
Dipole, Da:	5.68
IP(EA), eV:	-8.97(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-N-[1-(3-amino-4-fluorophenyl)-3-cyclopropyl-1-pyridin-4-ylpropyl]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=CC=C1C(C2=CC(=CC=C2)NC(=O)C3=CC(=NN3C4=CC=CC(=C4)C#N)C(F)(F)F)NCC5CC5

DOS

IR

Vibrations