Geometry & MOs

Info

ID:	213870
PubChem CID:	81065501
Reduced:	NO3C11H19 (1)
Stoich.:	AB3C11D19 (1)
Weight, g/mol:	314.066949
ΔH_f, kcal/mol:	-144.81
Dipole, Da:	3.45
IP(EA), eV:	-9.81(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2-chloro-5-nitrobenzoyl)amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)C1CC1C

DOS

IR

Vibrations