Geometry & MOs

Info

ID:

299540

PubChem CID:

117687410

Reduced:

OF2N5C14H21 (1)

Stoich.:

AB2C5D14E21 (1)

Weight, g/mol:

811.356263

ΔHf, kcal/mol:

-90.92

Dipole, Da:

3.84

IP(EA), eV:

 -8.91(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-dibenzofuran-4-yl-6-[(2E,5Z,7Z)-17,17-dimethyl-4-methylidene-3-(N-naphthalen-2-ylanilino)-14-tricyclo[8.7.0.011,16]heptadeca-1(10),2,5,7,11(16),12,14-heptaenyl]-N-phenylpyridin-3-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC2=C(C(=N1)N(CF)CF)N=CN2CCOC

DOS

IR

Vibrations