Geometry & MOs

Info

ID:	282709
PubChem CID:	103936814
Reduced:	NOC3H3 (3)
Stoich.:	ABC3D3 (3)
Weight, g/mol:	272.168877
ΔH_f, kcal/mol:	-72.17
Dipole, Da:	1.51
IP(EA), eV:	-9.9(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-fluoropyridin-2-yl)-N-[(1S)-1-(2-methylphenyl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=NC=CC(=C2N1)C(=O)O)O

DOS

IR

Vibrations