Geometry & MOs

Info

ID:

428957

PubChem CID:

135168542

Reduced:

N2H48C71 (1)

Stoich.:

A2B48C71 (1)

Weight, g/mol:

926.366099

ΔHf, kcal/mol:

289.9

Dipole, Da:

0.86

IP(EA), eV:

 -7.97(-0.53)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(9,9-dimethylfluoren-2-yl)-N-(9,9'-spirobi[fluorene]-2-yl)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

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC5=C(C=C4)C6(C7=CC=CC=C7C8=CC=CC=C86)C9=CC=CC1=C9N5C2=CC=CC=C12)C1=CC=CC2=C1C1=CC=CC=C1C2(C1=CC=CC=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations