Geometry & MOs

Info

ID:	389440
PubChem CID:	134992910
Reduced:	SiO2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	393.87492
ΔH_f, kcal/mol:	-51.2
Dipole, Da:	1.04
IP(EA), eV:	-9.18(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,8-diiodo-9-thiabicyclo[3.3.1]nonane

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)OO[C@@H](C)C1=CC=CC=C1

DOS

IR

Vibrations