Geometry & MOs

Info

ID:	282744
PubChem CID:	103937709
Reduced:	OSN3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	246.116841
ΔH_f, kcal/mol:	6.05
Dipole, Da:	2.68
IP(EA), eV:	-9.15(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[5-(4-fluorophenoxy)pyridin-2-yl]propan-1-amine

Drug info:

PubChemData

Smile

CC[C@H](C1=NC=C(C=C1)OCCC2=C(N=CS2)C)N

DOS

IR

Vibrations