Geometry & MOs

Info

ID:	295216
PubChem CID:	117521837
Reduced:	NOC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	208.096026
ΔH_f, kcal/mol:	-62.96
Dipole, Da:	3.04
IP(EA), eV:	-8.91(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-3,6-dimethylimidazo[1,2-b][1,2,4]triazole-5-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2(CCCN2)C(=O)N

DOS

IR

Vibrations