Geometry & MOs

Info

ID:	163698
PubChem CID:	58106719
Reduced:	AlFNOPC17H20 (1)
Stoich.:	ABCDEF17G20 (1)
Weight, g/mol:	531.267448
ΔH_f, kcal/mol:	-61.65
Dipole, Da:	1.84
IP(EA), eV:	-8.53(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-6-[1,1-bis(6-benzylpyridin-2-yl)ethyl]pyridine

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC(=C1O[Al])CCP)C2=CC=CC(=N2)CF

DOS

IR

Vibrations