Geometry & MOs

Info

ID:	385068
PubChem CID:	134978250
Reduced:	PO2S2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	166.135765
ΔH_f, kcal/mol:	-119.85
Dipole, Da:	5.41
IP(EA), eV:	-9.51(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CSP(=O)(SC1)CCC(=O)C2=CC=CC=C2

DOS

IR

Vibrations