Geometry & MOs

Info

ID:

439785

PubChem CID:

135229605

Reduced:

ClOF2N5C32H36 (1)

Stoich.:

ABC2D5E32F36 (1)

Weight, g/mol:

765.266779

ΔHf, kcal/mol:

-60.47

Dipole, Da:

6.54

IP(EA), eV:

 -8.36(-0.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-dibenzofuran-2-yl-N-(4-phenylphenyl)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]-2'-amine

Drug info:

PubChemData

Smile

C1CCN(C1)C[C@@H]2CCCC2CCC(=O)C3=CC=C(C=C3)C4=CN=C5C(=N4)N(CCN5)CC6=C(C=CC(=C6Cl)F)F

DOS

IR

Vibrations