Geometry & MOs

Info

ID:	405923
PubChem CID:	135076021
Reduced:	SF3O4C22H23 (1)
Stoich.:	AB3C4D22E23 (1)
Weight, g/mol:	489.104176
ΔH_f, kcal/mol:	-280.63
Dipole, Da:	4.68
IP(EA), eV:	-9.3(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[tert-butyl(diphenyl)silyl]-4-cyanophenyl] trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CC(C)C1=C[C@](CC1)(C)CC(=O)C2=C(C=CC3=CC=CC=C32)OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations