Geometry & MOs

Info

ID:

319496

PubChem CID:

126656385

Reduced:

ON2H26C42 (1)

Stoich.:

AB2C26D42 (1)

Weight, g/mol:

862.392314

ΔHf, kcal/mol:

165.97

Dipole, Da:

1.32

IP(EA), eV:

 -8.02(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9,9-dimethyl-N-[4-[12-(3-methyl-4-phenylcyclohexa-1,5-dien-1-yl)-9,10-dihydro-[1]benzofuro[2,3-a]carbazol-5-yl]phenyl]-N-(2-phenylphenyl)fluoren-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=C5C6=CC=CC=C6N(C5=C7C(=C4)C8=CC=CC=C8O7)C9=CC=CC=C9)C1=CC=CC=C12

DOS

IR

Vibrations