Geometry & MOs

Info

ID:	22231
PubChem CID:	596348
Reduced:	O3N4C8H10 (1)
Stoich.:	A3B4C8D10 (1)
Weight, g/mol:	210.07529
ΔH_f, kcal/mol:	-69.09
Dipole, Da:	9.36
IP(EA), eV:	-9.35(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(6-amino-4-oxo-1H-pyrimidin-5-yl)imino]acetate

Drug info:

PubChemData

Smile

CCOC(=O)C=NC1=C(NC=NC1=O)N

DOS

IR

Vibrations