Geometry & MOs

Info

ID:

442120

PubChem CID:

135249922

Reduced:

N2S2H38C47 (1)

Stoich.:

A2B2C38D47 (1)

Weight, g/mol:

744.419198

ΔHf, kcal/mol:

160.89

Dipole, Da:

0.48

IP(EA), eV:

 -8.65(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,4,4,5,5-pentamethyl-1-[4-[7'-[4-(2,4,4,5,5-pentamethylimidazol-1-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]imidazole

Drug info:

PubChemData

Smile

CC1(CSC(=N1)C2=CC=C(C=C2)C3=CC4=C(C=C3)C5=C(C46C7=CC=CC=C7C8=CC=CC=C68)C=C(C=C5)C9=CC=C(C=C9)C1=NC(CS1)(C)C)C

DOS

IR

Vibrations