Geometry & MOs

Info

ID:	413796
PubChem CID:	135086746
Reduced:	BrClFOSiC12H15 (1)
Stoich.:	ABCDEF12G15 (1)
Weight, g/mol:	237.958078
ΔH_f, kcal/mol:	-93.69
Dipole, Da:	3.76
IP(EA), eV:	-9.11(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzo[f][1,2,3]benzotrithiole 2-oxide

Drug info:

PubChemData

Smile

C[Si](C)(C)/C=C/COC1=CC(=C(C=C1Br)Cl)F

DOS

IR

Vibrations