Geometry & MOs

Info

ID:

440007

PubChem CID:

135229878

Reduced:

FO2N4C28H33 (1)

Stoich.:

AB2C4D28E33 (1)

Weight, g/mol:

915.350115

ΔHf, kcal/mol:

-50.71

Dipole, Da:

5.07

IP(EA), eV:

 -8.71(-0.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,9,9-triphenyl-N-(3-spiro[2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene-13,9'-fluorene]-3'-ylphenyl)fluoren-4-amine

Drug info:

PubChemData

Smile

C/C=C(\C(=C\1/C(=C)NCCN1CC2=C(C=CC(=C2O)F)C)\C)/C(=O)N3CCCC3C4=CN=CC=C4

DOS

IR

Vibrations