Geometry & MOs

Info

ID:	227639
PubChem CID:	87562147
Reduced:	ON4C10H12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	328.088164
ΔH_f, kcal/mol:	55.36
Dipole, Da:	3.7
IP(EA), eV:	-8.82(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(3-formyl-2-methyl-1H-indol-5-yl)-4-methyl-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CC1=CN(C=N1)C2=CN=C(C=C2)NOC

DOS

IR

Vibrations