Geometry & MOs

Info

ID:	442232
PubChem CID:	135250704
Reduced:	SN5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	722.478444
ΔH_f, kcal/mol:	82.79
Dipole, Da:	3.65
IP(EA), eV:	-8.32(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-tris[4-(2,4,4,5,5-pentamethylimidazol-1-yl)phenyl]pyrimidine

Drug info:

PubChemData

Smile

CSC1=CC=C(C=C1)N2CC3CCN(CC3C2)C4=NC=NC5=C4C=CN5

DOS

IR

Vibrations