Geometry & MOs

Info

ID:	182716
PubChem CID:	76929933
Reduced:	FO2N3C11H14 (1)
Stoich.:	AB2C3D11E14 (1)
Weight, g/mol:	272.148455
ΔH_f, kcal/mol:	-71.83
Dipole, Da:	3.67
IP(EA), eV:	-9.0(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(6-amino-1-ethyl-2,4-dioxo-1,3-diazinan-5-yl)amino]propanoate

Drug info:

PubChemData

Smile

CC(C(=NO)N)C(=O)N(C)C1=CC=C(C=C1)F

DOS

IR

Vibrations