Geometry & MOs

Info

ID:	141718
PubChem CID:	52921554
Reduced:	N3O5H21C24 (1)
Stoich.:	A3B5C21D24 (1)
Weight, g/mol:	431.148121
ΔH_f, kcal/mol:	-86.6
Dipole, Da:	8.57
IP(EA), eV:	-8.95(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-(2-hydroxybenzoyl)-3-[2-(2-methoxyphenyl)ethyl]imidazo[4,5-b]pyridine-5-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCN2C=NC3=C2N=C(C(=C3)C(=O)C4=CC=CC=C4O)C(=O)OC

DOS

IR

Vibrations