Geometry & MOs

Info

ID:	195867
PubChem CID:	78744319
Reduced:	N3O6H19C21 (1)
Stoich.:	A3B6C19D21 (1)
Weight, g/mol:	331.099063
ΔH_f, kcal/mol:	-141.55
Dipole, Da:	3.74
IP(EA), eV:	-9.13(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] 5-amino-3-methyl-1,2-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C1=NN=C(O1)C2=CC=C(C=C2)OC)OC(=O)CCN3C4=CC=CC=C4OC3=O

DOS

IR

Vibrations