Geometry & MOs

Info

ID:	7686
PubChem CID:	73731
Reduced:	BrPO2C22H22 (1)
Stoich.:	ABC2D22E22 (1)
Weight, g/mol:	428.05408
ΔH_f, kcal/mol:	-2.75
Dipole, Da:	35.25
IP(EA), eV:	-5.57(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethoxy-2-oxoethyl)-triphenylphosphanium;bromide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations