Geometry & MOs

Info

ID:	260033
PubChem CID:	103179263
Reduced:	NO3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	251.188529
ΔH_f, kcal/mol:	-113.47
Dipole, Da:	2.75
IP(EA), eV:	-8.76(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-[2-(3-methoxypropoxy)ethyl]-1-(2-methylphenyl)ethanamine

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=CC=C1)OC)NCCOCCCOC

DOS

IR

Vibrations