Geometry & MOs

Info

ID:	11242
PubChem CID:	112344
Reduced:	N2O3H16C18 (1)
Stoich.:	A2B3C16D18 (1)
Weight, g/mol:	308.116092
ΔH_f, kcal/mol:	-59.49
Dipole, Da:	8.03
IP(EA), eV:	-8.62(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-ethyl-2-methylindole-3-carbonyl)pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=CC=N3)C(=O)O)C

DOS

IR

Vibrations