Geometry & MOs

Info

ID:	384469
PubChem CID:	134977041
Reduced:	NPSO4H22C25 (1)
Stoich.:	ABCD4E22F25 (1)
Weight, g/mol:	490.141394
ΔH_f, kcal/mol:	-90.51
Dipole, Da:	8.85
IP(EA), eV:	-8.94(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-3-methyl-2,2-diphenyl-3,4-dihydro-1H-isophosphinolin-2-ium;hexafluorophosphate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2NC3=CC=CC=C3P2(C4=CC=CC=C4)(C5=CC=CC=C5)OS(=O)(=O)O

DOS

IR

Vibrations