Geometry & MOs

Info

ID:	167849
PubChem CID:	74886440
Reduced:	N2O2C5H5 (2)
Stoich.:	A2B2C5D5 (2)
Weight, g/mol:	202.070205
ΔH_f, kcal/mol:	-112.57
Dipole, Da:	6.5
IP(EA), eV:	-9.46(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dioxo-1,2,4-triazinan-6-yl)-methylamino]acetic acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC2C(=O)NC(=O)NN2)C(=O)O

DOS

IR

Vibrations