Geometry & MOs

Info

ID:	227891
PubChem CID:	87562874
Reduced:	O4C11H14 (1)
Stoich.:	A4B11C14 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-82.19
Dipole, Da:	3.76
IP(EA), eV:	-8.64(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-4-[2-(4-propylphenyl)ethynyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

COOC=O.C1CC2=CC=CC=C2OC1

DOS

IR

Vibrations