Geometry & MOs

Info

ID:

336825

PubChem CID:

127255832

Reduced:

PO4H41C48 (1)

Stoich.:

AB4C41D48 (1)

Weight, g/mol:

614.297351

ΔHf, kcal/mol:

-132.62

Dipole, Da:

4.03

IP(EA), eV:

 -8.72(-0.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-[4-(3-phenanthren-9-yl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl]phenanthrene

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=C(C=C2C3=CC(=CC4=C3CCCC4)C5=CC6=CC=CC=C6C7=CC=CC=C75)C8=CC9=CC=CC=C9C1=CC=CC=C18.OP(=O)(O)O

DOS

IR

Vibrations