Geometry & MOs

Info

ID:	24869
PubChem CID:	614145
Reduced:	OPSC11H13 (1)
Stoich.:	ABCD11E13 (1)
Weight, g/mol:	224.042473
ΔH_f, kcal/mol:	-68.75
Dipole, Da:	4.74
IP(EA), eV:	-8.87(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-1-sulfanylidene-1lambda5-phosphinan-4-one

Drug info:

PubChemData

Smile

C1CP(=S)(CCC1=O)C2=CC=CC=C2

DOS

IR

Vibrations