Geometry & MOs

Info

ID:

163643

PubChem CID:

58106509

Reduced:

SF4H10C26 (1)

Stoich.:

AB4C10D26 (1)

Weight, g/mol:

440.069343

ΔHf, kcal/mol:

-20.29

Dipole, Da:

4.46

IP(EA), eV:

-8.73(-2.02)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4,13-diphenyl-3,14-dithiahexacyclo[8.8.2.02,6.07,19.011,15.016,20]icosa-1,4,6,8,10,12,15,17,19-nonaene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=C4C=CC5=C6C(=C7C5=C4C(=C3S2)C=C7)C(=C(C(=C6F)F)F)F

DOS

IR

Vibrations