Geometry & MOs

Info

ID:	48885
PubChem CID:	11528437
Reduced:	O2C11H12 (1)
Stoich.:	A2B11C12 (1)
Weight, g/mol:	176.069113
ΔH_f, kcal/mol:	-27.46
Dipole, Da:	1.68
IP(EA), eV:	-9.45(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,3-trimethyl-1,3-thiasilinane 1-oxide

Drug info:

PubChemData

Smile

C=C(COCC1=CC=CC=C1)C=O

DOS

IR

Vibrations