Geometry & MOs

Info

ID:

379363

PubChem CID:

134419176

Reduced:

NC17H31 (1)

Stoich.:

AB17C31 (1)

Weight, g/mol:

1554.600517

ΔHf, kcal/mol:

-45.08

Dipole, Da:

1.39

IP(EA), eV:

-8.63(1.62)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(N-[3-[4-[N-[7'-(hydroxymethyl)-9,9'-spirobi[fluorene]-2'-yl]-2-[[4-[4-methyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenyl]methyl]anilino]phenyl]phenyl]anilino)-9,9'-spirobi[fluorene]-2',7'-dicarbonitrile

Drug info:

PubChemData

Smile

CC(=C1CCCCC1)CCCNC2CCCCC2

DOS

IR

Vibrations