Geometry & MOs

Info

ID:	335510
PubChem CID:	127254372
Reduced:	O3N4H18C20 (1)
Stoich.:	A3B4C18D20 (1)
Weight, g/mol:	410.104876
ΔH_f, kcal/mol:	29.68
Dipole, Da:	7.79
IP(EA), eV:	-9.11(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-N-[4-(5-methoxy-2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]-4-oxo-1H-pyridine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C2=CC=NC3=NC(=NN23)C4=CC=CC=C4)OC)OC

DOS

IR

Vibrations