Geometry & MOs

Info

ID:	378016
PubChem CID:	134224084
Reduced:	ON3H23C29 (1)
Stoich.:	AB3C23D29 (1)
Weight, g/mol:	583.262363
ΔH_f, kcal/mol:	128.08
Dipole, Da:	2.96
IP(EA), eV:	-8.43(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4,6-diphenyl-2-[3-[6-(2-phenylmethoxyphenyl)pyridin-3-yl]phenyl]-4H-pyrimidine

Drug info:

PubChemData

Smile

C/C=C\C1=C(C=CC(=C1N=C)OCC2=CC=CC=C2)C3=NC4=C(C=CC5=C4N=CC=C5)C=C3

DOS

IR

Vibrations