Geometry & MOs

Info

ID:	403119
PubChem CID:	135058815
Reduced:	SN2O3C10H14 (1)
Stoich.:	AB2C3D10E14 (1)
Weight, g/mol:	345.190009
ΔH_f, kcal/mol:	-66.24
Dipole, Da:	5.21
IP(EA), eV:	-8.83(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)naphthalen-1-yl]pyridine

Drug info:

PubChemData

Smile

C/C(=N\OC)/C1=CC=CC=C1NS(=O)(=O)C

DOS

IR

Vibrations