Geometry & MOs

Info

ID:

311872

PubChem CID:

126598661

Reduced:

NH27C30 (2)

Stoich.:

AB27C30 (2)

Weight, g/mol:

776.376664

ΔHf, kcal/mol:

157.7

Dipole, Da:

3.18

IP(EA), eV:

 -7.95(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-(1,1,2,2,3,3-hexamethyl-9-phenylcyclopenta[b]carbazol-6-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-2-amine

Drug info:

PubChemData

Smile

CC1(C2=C(C3=CC=CC=C31)C(=CC=C2)N(C4=CC=C(C=C4)C5=CC=CC=C5)C6=CC=C(C=C6)C7=CC=C(C=C7)N8C9=CC=CC=C9C1=CC2=C(C=C18)C(C(C2(C)C)(C)C)(C)C)C

DOS

IR

Vibrations