Geometry & MOs

Info

ID:	140349
PubChem CID:	52685730
Reduced:	N2O3C25H26 (1)
Stoich.:	A2B3C25D26 (1)
Weight, g/mol:	291.207253
ΔH_f, kcal/mol:	-69.89
Dipole, Da:	3.39
IP(EA), eV:	-9.02(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]-methyl-[3-(2-methylphenoxy)propyl]azanium

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCC2=CC(=CC=C2)OCC3=CC=CC=C3)C

DOS

IR

Vibrations