Geometry & MOs

Info

ID:

299110

PubChem CID:

117671434

Reduced:

N2F3H39C53 (1)

Stoich.:

A2B3C39D53 (1)

Weight, g/mol:

792.296363

ΔHf, kcal/mol:

33.44

Dipole, Da:

5.64

IP(EA), eV:

 -7.87(-1.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-N-(4-methoxynaphthalen-1-yl)-7,7-dimethyl-5-N,9-N-diphenyl-5-N-[4-(trifluoromethoxy)naphthalen-1-yl]benzo[c]fluorene-5,9-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(C2=CC=CC=C12)N(C3=CC=CC=C3)C4=CC5=C(C6=C(C5(C)C)C=C(C=C6)N(C7=CC=CC=C7)C8=CC=C(C9=CC=CC=C98)C(F)(F)F)C1=CC=CC=C14

DOS

IR

Vibrations