Geometry & MOs

Info

ID:

233481

PubChem CID:

90944813

Reduced:

F3N3O4H20C24 (1)

Stoich.:

A3B3C4D20E24 (1)

Weight, g/mol:

1110.045995

ΔHf, kcal/mol:

-204.73

Dipole, Da:

1.58

IP(EA), eV:

 -9.25(-1.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1,3,4,5,6,7,8-heptafluoro-2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(1,3,4,5,6,7,8-heptafluoro-3,4,7,8-tetrahydronaphthalen-2-yl)cyclohexa-1,3-dien-1-yl]cyclohexa-1,3-dien-1-yl]phenyl]cyclohexa-1,3-dien-1-yl]-1,8a-dihydronaphthalene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2C3=C(CCN(C3=O)C4=CC=C(C=C4)C(=O)OC5CC5)C(=N2)C(F)(F)F

DOS

IR

Vibrations