Geometry & MOs

Info

ID:	410121
PubChem CID:	135082910
Reduced:	NPSF3O3H25C32 (1)
Stoich.:	ABCD3E3F25G32 (1)
Weight, g/mol:	488.0976
ΔH_f, kcal/mol:	-148.25
Dipole, Da:	13.5
IP(EA), eV:	-9.63(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[triphenyl-(3,3,3-trifluoro-2-hydroxypropyl)-lambda5-phosphanyl] 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=NC2=CC=CC=C2P(C3=CC=CC=C3)(C4=CC=CC=C4)(C5=CC=CC=C5)OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations