Geometry & MOs

Info

ID:	265753
PubChem CID:	103544308
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	226.10659
ΔH_f, kcal/mol:	-40.05
Dipole, Da:	6.6
IP(EA), eV:	-8.89(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-amino-1-(2-amino-2-oxoethyl)-2-ethylimidazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2C=NC(=C2N)C(=O)OC)C

DOS

IR

Vibrations