Geometry & MOs

Info

ID:	21825
PubChem CID:	591728
Reduced:	N3O6C11H11 (1)
Stoich.:	A3B6C11D11 (1)
Weight, g/mol:	281.064785
ΔH_f, kcal/mol:	-148.65
Dipole, Da:	7.04
IP(EA), eV:	-10.54(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[(4-nitrobenzoyl)amino]acetyl]amino]acetic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NCC(=O)NCC(=O)O)[N+](=O)[O-]

DOS

IR

Vibrations