Geometry & MOs

Info

ID:	404330
PubChem CID:	135065898
Reduced:	SO3C18H20 (1)
Stoich.:	AB3C18D20 (1)
Weight, g/mol:	1685.93789
ΔH_f, kcal/mol:	-45.02
Dipole, Da:	1.16
IP(EA), eV:	-8.49(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,5,10,10,11-hexakis(2,3,4,5,6-pentafluorophenyl)-2,6,8,12-tetraphenyl-1,7-ditelluronia-4,10-diboranuidatricyclo[7.3.0.03,7]dodeca-2,5,8,11-tetraene

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C12C(CCC1=O)C=C2SC3=CC=CC=C3

DOS

IR

Vibrations