Geometry & MOs

Info

ID:	432230
PubChem CID:	135172362
Reduced:	NOC13H21 (1)
Stoich.:	ABC13D21 (1)
Weight, g/mol:	224.152478
ΔH_f, kcal/mol:	-44.47
Dipole, Da:	1.08
IP(EA), eV:	-8.69(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(5-ethoxypyridin-2-yl)oxy-N-ethylpropan-1-amine

Drug info:

PubChemData

Smile

CCCC1=CC(=CC=C1)O[C@H](C)CNC

DOS

IR

Vibrations