Geometry & MOs

Info

ID:	321926
PubChem CID:	126667395
Reduced:	NO3H11C16 (1)
Stoich.:	AB3C11D16 (1)
Weight, g/mol:	290.069142
ΔH_f, kcal/mol:	-31.49
Dipole, Da:	8.26
IP(EA), eV:	-10.01(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-cyanonaphthalen-1-yl)-5-hydroxypyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CC2=C1C=C(C=C2C3=CC(=C(C=C3)C(=O)O)O)C#N

DOS

IR

Vibrations