Geometry & MOs

Info

ID:	383331
PubChem CID:	134975002
Reduced:	PSO4C13H13 (1)
Stoich.:	ABC4D13E13 (1)
Weight, g/mol:	296.027217
ΔH_f, kcal/mol:	-141.81
Dipole, Da:	3.92
IP(EA), eV:	-8.91(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1-benzothiophen-2-yl)-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3,2]dioxaphosphepine

Drug info:

PubChemData

Smile

C1[C@@H]2C(COP(O1)C3=CC4=CC=CC=C4S3)OCO2

DOS

IR

Vibrations