Geometry & MOs

Info

ID:	213904
PubChem CID:	81065535
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	280.105922
ΔH_f, kcal/mol:	-127.35
Dipole, Da:	2.01
IP(EA), eV:	-9.92(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2-nitrobenzoyl)amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)CCC1=CN=CC=C1

DOS

IR

Vibrations