Geometry & MOs

Info

ID:	51388
PubChem CID:	12014046
Reduced:	SO2Si2C30H58 (1)
Stoich.:	AB2C2D30E58 (1)
Weight, g/mol:	552.10953
ΔH_f, kcal/mol:	-227.1
Dipole, Da:	2.76
IP(EA), eV:	-8.26(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S,6S)-1,3-dibromo-5,6-dioctoxy-4,5,6,7-tetrahydro-2-benzothiophene

Drug info:

PubChemData

Smile

CCCCCCCCO[C@H]1CC2=C(SC(=C2C[C@@H]1OCCCCCCCC)[Si](C)(C)C)[Si](C)(C)C

DOS

IR

Vibrations