Geometry & MOs

Info

ID:	442236
PubChem CID:	135250741
Reduced:	S3N8C34H34 (1)
Stoich.:	A3B8C34D34 (1)
Weight, g/mol:	911.511141
ΔH_f, kcal/mol:	165.2
Dipole, Da:	1.25
IP(EA), eV:	-9.09(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-tris[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridin-2-yl]pyrimidine

Drug info:

PubChemData

Smile

CC1(CSC(=N1)C2=CN=C(C=C2)C3=CC(=NC(=N3)C4=NC=C(C=C4)C5=NC(CS5)(C)C)C6=NC=C(C=C6)C7=NC(CS7)(C)C)C

DOS

IR

Vibrations