Geometry & MOs

Info

ID:

377690

PubChem CID:

134223754

Reduced:

NO3C20H29 (1)

Stoich.:

AB3C20D29 (1)

Weight, g/mol:

739.262363

ΔHf, kcal/mol:

-133.16

Dipole, Da:

2.69

IP(EA), eV:

 -8.78(0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-(9,14-diphenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-6-yl)-11-phenyl-[1]benzofuro[3,2-b]carbazole

Drug info:

PubChemData

Smile

CC(=C)C1CCC(C[C@]1(C)C(=O)NC2=C(C=C(C=C2)OC)O)(C)C

DOS

IR

Vibrations