Geometry & MOs

Info

ID:	389693
PubChem CID:	134994486
Reduced:	OSC13H18 (1)
Stoich.:	ABC13D18 (1)
Weight, g/mol:	133.068711
ΔH_f, kcal/mol:	-9.95
Dipole, Da:	1.93
IP(EA), eV:	-9.1(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-methoxy-3,3-dimethylthietan-1-ium

Drug info:

PubChemData

Smile

CCCCOCC1C(S1)C2=CC=CC=C2

DOS

IR

Vibrations