Geometry & MOs

Info

ID:	2
PubChem CID:	1921
Reduced:	N3O3C13H19 (1)
Stoich.:	A3B3C13D19 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-104.84
Dipole, Da:	3.42
IP(EA), eV:	-9.08(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butyl-2-(methoxymethyl)-6-methyl-1H-imidazo[4,5-b]pyridine-5,7-dione

Drug info:

PubChemData

Smile

CCCCN1C(=O)C(C(=O)C2=C1N=C(N2)COC)C

DOS

IR

Vibrations