Geometry & MOs

Info

ID:	12787
PubChem CID:	145563
Reduced:	OSC5H8 (1)
Stoich.:	ABC5D8 (1)
Weight, g/mol:	116.029586
ΔH_f, kcal/mol:	22.96
Dipole, Da:	4.85
IP(EA), eV:	-8.46(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethynylsulfinylpropane

Drug info:

PubChemData

Smile

CCCS(=O)C#C

DOS

IR

Vibrations