Geometry & MOs

Info

ID:	251411
PubChem CID:	103103771
Reduced:	O4N5C9H13 (1)
Stoich.:	A4B5C9D13 (1)
Weight, g/mol:	231.121906
ΔH_f, kcal/mol:	-111.7
Dipole, Da:	6.93
IP(EA), eV:	-10.44(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[(2-amino-2-oxoethyl)-ethylcarbamoyl]amino]acetate

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)CN1C=C(N=N1)C(=O)O

DOS

IR

Vibrations