Geometry & MOs

Info

ID:	442358
PubChem CID:	135251560
Reduced:	S2O4F5H5C8 (1)
Stoich.:	A2B4C5D5E8 (1)
Weight, g/mol:	258.159535
ΔH_f, kcal/mol:	-362.75
Dipole, Da:	2.01
IP(EA), eV:	-10.59(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-2,3,5,6-tetramethyl-4-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

CS(=O)(=O)CS(=O)(=O)C1=C(C(=C(C(=C1F)F)F)F)F

DOS

IR

Vibrations