Geometry & MOs

Info

ID:	377986
PubChem CID:	134224053
Reduced:	ON3H25C36 (1)
Stoich.:	AB3C25D36 (1)
Weight, g/mol:	493.19026
ΔH_f, kcal/mol:	150.17
Dipole, Da:	3.7
IP(EA), eV:	-8.7(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[6-(2-methoxyphenyl)pyridin-2-yl]phenyl]-2,6-dipyridin-3-ylpyrimidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=CC=C2C3=CC=CC(=N3)C4=CC(=CC=C4)C5=NC6=C(C=CC7=C6N=CC=C7)C=C5

DOS

IR

Vibrations