Geometry & MOs

Info

ID:	126075
PubChem CID:	50950523
Reduced:	N3O3C16H23 (1)
Stoich.:	A3B3C16D23 (1)
Weight, g/mol:	374.114568
ΔH_f, kcal/mol:	-113.78
Dipole, Da:	4.23
IP(EA), eV:	-8.91(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(6-chloropyridin-2-yl)methyl]-2-oxo-3-pentan-3-ylimidazo[4,5-b]pyridine-6-carboxylic acid

Drug info:

PubChemData

Smile

CN1C[C@@H](C[C@H]1CO)NC(=O)C2=C(N=C3CCCC3=C2)OC

DOS

IR

Vibrations