Geometry & MOs

Info

ID:	412947
PubChem CID:	135085884
Reduced:	SBr2F3H5C9 (1)
Stoich.:	AB2C3D5E9 (1)
Weight, g/mol:	270.074592
ΔH_f, kcal/mol:	-115.99
Dipole, Da:	3.45
IP(EA), eV:	-9.32(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-trimethylsilylethenyl 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)C(F)(F)F)S)C=C(Br)Br

DOS

IR

Vibrations