Geometry & MOs

Info

ID:	213591
PubChem CID:	81064319
Reduced:	N2O4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	293.162708
ΔH_f, kcal/mol:	-174.59
Dipole, Da:	5.87
IP(EA), eV:	-9.14(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(3-methylphenoxy)propanoylamino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)C1=CC(=CC=C1)NC(=O)C

DOS

IR

Vibrations