Geometry & MOs

Info

ID:	262586
PubChem CID:	103302695
Reduced:	FSO2N3C11H16 (1)
Stoich.:	ABC2D3E11F16 (1)
Weight, g/mol:	301.165349
ΔH_f, kcal/mol:	-91.85
Dipole, Da:	6.42
IP(EA), eV:	-9.29(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxolan-2-yl)-N-propyl-1-(2,4,5-trifluorophenyl)propan-1-amine

Drug info:

PubChemData

Smile

C1C[C@@H](NC1)CCNS(=O)(=O)C2=C(C=CC=N2)F

DOS

IR

Vibrations