Geometry & MOs

Info

ID:	321515
PubChem CID:	126666495
Reduced:	F5H5C14 (1)
Stoich.:	A5B5C14 (1)
Weight, g/mol:	490.153741
ΔH_f, kcal/mol:	-175.88
Dipole, Da:	1.26
IP(EA), eV:	-9.12(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-methyl-6-(2-methylsulfanylphenyl)pyridin-3-yl]-5-(3-methylthiophen-2-yl)-3-(2-phenylethenyl)pyridine

Drug info:

PubChemData

Smile

C1=C2C=C(C=C(C2=C(C3=C(C=C(C=C31)F)F)F)F)F

DOS

IR

Vibrations