Geometry & MOs

Info

ID:

428414

PubChem CID:

135167277

Reduced:

N2H36C55 (1)

Stoich.:

A2B36C55 (1)

Weight, g/mol:

964.38175

ΔHf, kcal/mol:

247.5

Dipole, Da:

0.54

IP(EA), eV:

 -7.71(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC=C2C3=CC=CC=C3N(C4=CC=CC=C4)C5=CC6=C(C=C5)N7C8=CC=CC=C8C9(C1=CC=CC=C1C1=CC=CC=C19)C1=CC=CC6=C17

DOS

IR

Vibrations