Geometry & MOs

Info

ID:	285738
PubChem CID:	104123672
Reduced:	N2O3C13H20 (1)
Stoich.:	A2B3C13D20 (1)
Weight, g/mol:	270.136828
ΔH_f, kcal/mol:	-122.92
Dipole, Da:	6.92
IP(EA), eV:	-8.85(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethyl-N-methylanilino)-6-methylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCCN(CCO)C1=NC(=CC(=C1)C(=O)O)C

DOS

IR

Vibrations