Geometry & MOs

Info

ID:	195147
PubChem CID:	78643921
Reduced:	N2O4H14C19 (1)
Stoich.:	A2B4C14D19 (1)
Weight, g/mol:	310.152872
ΔH_f, kcal/mol:	1.66
Dipole, Da:	4.16
IP(EA), eV:	-8.56(-2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-methoxyethylamino)-1-oxopropan-2-yl] 2-(2-hydroxyethylamino)benzoate

Drug info:

PubChemData

Smile

COC1=CC(=CC2=C1OCCO2)C=C=C3C(=O)N=C4C=CC=CC4=N3

DOS

IR

Vibrations