Geometry & MOs

Info

ID:	7687
PubChem CID:	73732
Reduced:	PO2C22H22 (1)
Stoich.:	AB2C22D22 (1)
Weight, g/mol:	349.135742
ΔH_f, kcal/mol:	-18.71
Dipole, Da:	6.66
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.954898
Charge, e:	1

Chem-info

IUPAC name:

(2-ethoxy-2-oxoethyl)-triphenylphosphanium

Drug info:

PubChemData

Smile

CCOC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations