Geometry & MOs

Info

ID:	259800
PubChem CID:	103174867
Reduced:	ON3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	271.168462
ΔH_f, kcal/mol:	10.51
Dipole, Da:	2.22
IP(EA), eV:	-9.16(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[5-(2-ethyl-6-methylpyridin-3-yl)oxypyridin-2-yl]propan-1-amine

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=N1)C)OC2=CC(=C(C=C2)C(=N)N)C

DOS

IR

Vibrations