Geometry & MOs

Info

ID:	425332
PubChem CID:	135125953
Reduced:	NO2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	340.262697
ΔH_f, kcal/mol:	-130.23
Dipole, Da:	4.28
IP(EA), eV:	-8.74(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-N-[(2S)-3-phenyl-2-(2-phenylethylamino)propyl]butane-1,2,4-triamine

Drug info:

PubChemData

Smile

C1CCOC(C1)ONC(=O)N2CCC3(CC2)CC4=CC=CC=C4O3

DOS

IR

Vibrations