Geometry & MOs

Info

ID:	384282
PubChem CID:	134976677
Reduced:	PSO5H33C35 (1)
Stoich.:	ABC5D33E35 (1)
Weight, g/mol:	378.138482
ΔH_f, kcal/mol:	-115.05
Dipole, Da:	7.59
IP(EA), eV:	-9.4(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxopropan-2-yl(triphenyl)-lambda5-phosphanyl] acetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OP(C2=CC=CC=C2)(C3=CC=CC=C3)(C4=CC=CC=C4)C(CC5=CC=CC=C5)C(=O)OC

DOS

IR

Vibrations