Geometry & MOs

Info

ID:	325949
PubChem CID:	126685753
Reduced:	ClON2H8C9 (2)
Stoich.:	ABC2D8E9 (2)
Weight, g/mol:	232.096026
ΔH_f, kcal/mol:	-18.28
Dipole, Da:	6.09
IP(EA), eV:	-9.61(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-methyl-2-pyrazin-2-yl-1H-imidazole-4-carboxylate

Drug info:

PubChemData

Smile

CCC1=CN=CC(=N1)C2=NC(=C(N2CC3=C(C=CC(=C3)Cl)Cl)C(=O)O)C

DOS

IR

Vibrations