Geometry & MOs

Info

ID:	207040
PubChem CID:	80336927
Reduced:	O3N4C12H18 (1)
Stoich.:	A3B4C12D18 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-88.48
Dipole, Da:	6.28
IP(EA), eV:	-9.46(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-[(2-methoxypyridin-3-yl)methoxy]phenyl]ethanamine

Drug info:

PubChemData

Smile

CCCC(C(=O)O)NC1=NN=C(C=C1)C(=O)N(C)C

DOS

IR

Vibrations