Geometry & MOs

Info

ID:

445993

PubChem CID:

135271133

Reduced:

NH22C32 (2)

Stoich.:

AB22C32 (2)

Weight, g/mol:

781.280321

ΔHf, kcal/mol:

265.47

Dipole, Da:

0.94

IP(EA), eV:

 -7.87(-0.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)-9,9'-spirobi[fluorene]-1-amine

Drug info:

PubChemData

Smile

CC1(C2=C(C3=CC=CC=C31)C(=CC=C2)N(C4=CC=C(C=C4)C5=CC6=C(C=C5)N(C7=CC=CC=C76)C8=CC=CC=C8)C9=CC=CC1=C9C2(C3=CC=CC=C13)C1=CC=CC=C1C1=CC=CC=C21)C

DOS

IR

Vibrations