Geometry & MOs

Info

ID:

443013

PubChem CID:

135257409

Reduced:

N2H19C20 (2)

Stoich.:

A2B19C20 (2)

Weight, g/mol:

704.312682

ΔHf, kcal/mol:

152.84

Dipole, Da:

3.12

IP(EA), eV:

 -7.8(0.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[4-(8-methyl-2,3,4,4a,5,6,7,8a-octahydro-1H-1,8-naphthyridin-4-yl)phenyl]-5-phenyl-2-[2-(trifluoromethyl)phenyl]indolo[2,3-b]carbazole

Drug info:

PubChemData

Smile

CN1C(C=C(N(C1C2=CC=CC=C2)C)C3=CC=CC=C3)C4=CC(=CC(=C4)N5CCC6=CC=CC=C65)N7CCC8=CC=CC=C87

DOS

IR

Vibrations