Geometry & MOs

Info

ID:

441279

PubChem CID:

135233956

Reduced:

ON3H29C45 (1)

Stoich.:

AB3C29D45 (1)

Weight, g/mol:

718.262028

ΔHf, kcal/mol:

196.46

Dipole, Da:

1.73

IP(EA), eV:

 -9.07(-1.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[8-(4b,5-dihydrotriphenylen-2-yl)dibenzofuran-1-yl]-4-dibenzofuran-4-yl-6-phenyl-1,4-dihydropyrimidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NC(=N3)C4=CC5=C(C=C4)OC6=CC=CC(=C65)C7=CC=CC=C7)C8=CC=C(C=C8)C9=CC=CC=C9

DOS

IR

Vibrations