Geometry & MOs

Info

ID:

440060

PubChem CID:

135229945

Reduced:

ION3C16H22 (1)

Stoich.:

ABC3D16E22 (1)

Weight, g/mol:

1155.444015

ΔHf, kcal/mol:

-15.41

Dipole, Da:

5.66

IP(EA), eV:

 -8.78(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(9-cyclohexa-1,3-dien-1-yl-9-phenylfluoren-3-yl)-N-(4-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]-4'-ylphenyl)-9,9'-spirobi[fluorene]-2-amine

Drug info:

PubChemData

Smile

C1CCN(C1)C[C@H]2CCCN2C(=O)NC3=CC=C(C=C3)I

DOS

IR

Vibrations