Geometry & MOs

Info

ID:	376853
PubChem CID:	134222882
Reduced:	FOPH25C27 (1)
Stoich.:	ABCD25E27 (1)
Weight, g/mol:	444.175804
ΔH_f, kcal/mol:	9.04
Dipole, Da:	9.14
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.908222
Charge, e:	1

Chem-info

IUPAC name:

[3-(2-(18F)fluoranylethoxy)phenyl]-[(4-methoxyphenyl)methyl]-diphenylphosphanium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC(=C4)OCC[18F]

DOS

IR

Vibrations