Geometry & MOs

Info

ID:	227107
PubChem CID:	87560202
Reduced:	ClPH25C29 (1)
Stoich.:	ABC25D29 (1)
Weight, g/mol:	403.161563
ΔH_f, kcal/mol:	113.07
Dipole, Da:	18.04
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.863094
Charge, e:	1

Chem-info

IUPAC name:

methyl-(2-naphthalen-1-ylphenyl)-diphenylphosphanium

Drug info:

PubChemData

Smile

C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC=C2Cl

DOS

IR

Vibrations