Geometry & MOs

Info

ID:	265789
PubChem CID:	103546223
Reduced:	N3O3C10H11 (1)
Stoich.:	A3B3C10D11 (1)
Weight, g/mol:	219.075625
ΔH_f, kcal/mol:	-56.42
Dipole, Da:	4.8
IP(EA), eV:	-9.02(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-amino-1-pyrimidin-2-ylimidazole-4-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(N(C=N1)CC2=COC=C2)N

DOS

IR

Vibrations