Geometry & MOs

Info

ID:	128612
PubChem CID:	51052156
Reduced:	NO3H10C11 (2)
Stoich.:	AB3C10D11 (2)
Weight, g/mol:	393.132471
ΔH_f, kcal/mol:	-176.24
Dipole, Da:	13.72
IP(EA), eV:	-8.68(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethoxyphenyl)-5-oxo-7-pyridin-3-yl-6,7-dihydro-4H-pyrrolo[3,2-b]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)N2C=C(C3=C2C(CC(=O)N3)C4=CC(=CC=C4)O)C(=O)O

DOS

IR

Vibrations