Geometry & MOs

Info

ID:	397278
PubChem CID:	135029988
Reduced:	NO2H15C24 (1)
Stoich.:	AB2C15D24 (1)
Weight, g/mol:	272.106196
ΔH_f, kcal/mol:	39.42
Dipole, Da:	6.69
IP(EA), eV:	-9.1(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-naphthalen-2-yltriazol-4-yl)pyridine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=NC3=C2C4=CC=CC=C4OC3=O)C5=CC=CC=C5

DOS

IR

Vibrations