Geometry & MOs

Info

ID:	213008
PubChem CID:	81062484
Reduced:	N2O3C15H30 (1)
Stoich.:	A2B3C15D30 (1)
Weight, g/mol:	246.194343
ΔH_f, kcal/mol:	-161.09
Dipole, Da:	0.54
IP(EA), eV:	-8.76(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-ethoxyethyl(methyl)amino]-2-(propylamino)butanoic acid

Drug info:

PubChemData

Smile

CCNC1(CCC(C1)N(C)CCOCC)C(=O)OCC

DOS

IR

Vibrations