Geometry & MOs

Info

ID:	395453
PubChem CID:	135025514
Reduced:	SSiF3O3H27C28 (1)
Stoich.:	ABC3D3E27F28 (1)
Weight, g/mol:	333.107794
ΔH_f, kcal/mol:	-234.68
Dipole, Da:	3.64
IP(EA), eV:	-8.69(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)-3,5-bis(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

CC1=C(C2=CC(=C(C=C2C(=C1C)C3=CC=CC=C3)[Si](C)(C)C)OS(=O)(=O)C(F)(F)F)C4=CC=CC=C4

DOS

IR

Vibrations