Geometry & MOs

Info

ID:	443178
PubChem CID:	135257982
Reduced:	N3O4C12H17 (1)
Stoich.:	A3B4C12D17 (1)
Weight, g/mol:	529.02237
ΔH_f, kcal/mol:	-140.31
Dipole, Da:	5.79
IP(EA), eV:	-9.04(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-3-[[2-chloro-5-[(7-chloro-3-methylimidazo[4,5-b]pyridine-6-carbonyl)amino]phenyl]methyl]imidazo[4,5-b]pyridine-6-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(=CNC1=NC=CN1C)C(=O)OCC

DOS

IR

Vibrations