Geometry & MOs

Info

ID:	338339
PubChem CID:	127259031
Reduced:	SO4H12C14 (1)
Stoich.:	AB4C12D14 (1)
Weight, g/mol:	442.115638
ΔH_f, kcal/mol:	-115.82
Dipole, Da:	5.46
IP(EA), eV:	-9.88(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[phenylsulfanyl-(triphenyl-lambda5-phosphanylidene)methyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=CC=C1S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations