Geometry & MOs

Info

ID:	386174
PubChem CID:	134980978
Reduced:	SSiO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	236.159642
ΔH_f, kcal/mol:	-86.1
Dipole, Da:	6.14
IP(EA), eV:	-9.29(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,7aS)-3a-[(E)-2-trimethylsilylethenyl]-2,3,4,6,7,7a-hexahydro-1H-inden-5-one

Drug info:

PubChemData

Smile

C[Si](C)(C)C1=CCS(=O)(=O)C1C2=CC=CC=C2

DOS

IR

Vibrations