Geometry & MOs

Info

ID:

439964

PubChem CID:

135229835

Reduced:

NOH39C64 (1)

Stoich.:

ABC39D64 (1)

Weight, g/mol:

915.350115

ΔHf, kcal/mol:

248.1

Dipole, Da:

0.75

IP(EA), eV:

 -7.98(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,9,9-triphenyl-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]-3'-ylphenyl)fluoren-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC3=C(C=C2)C4=CC=CC=C4C35C6=CC=CC=C6C7=CC=CC=C57)C8=CC=CC9=C8C1=CC=CC=C1C91C2=C(C3=CC=CC=C3C=C2)OC2=C1C=CC1=CC=CC=C12

DOS

IR

Vibrations