Geometry & MOs

Info

ID:	126725
PubChem CID:	50974925
Reduced:	NOC8H13 (2)
Stoich.:	ABC8D13 (2)
Weight, g/mol:	359.128134
ΔH_f, kcal/mol:	-101.55
Dipole, Da:	4.25
IP(EA), eV:	-9.24(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethoxyethyl)-3-[(4-fluorophenyl)methyl]-2-oxoimidazo[4,5-b]pyridine-6-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)NC(=O)CNCC(C)(C)CO

DOS

IR

Vibrations