Geometry & MOs

Info

ID:	387537
PubChem CID:	134985757
Reduced:	SC13H18 (1)
Stoich.:	AB13C18 (1)
Weight, g/mol:	172.055801
ΔH_f, kcal/mol:	9.19
Dipole, Da:	0.78
IP(EA), eV:	-8.48(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methylpropanethioyl)oxolan-2-one

Drug info:

PubChemData

Smile

CCCCS/C(=C/C1=CC=CC=C1)/C

DOS

IR

Vibrations