Geometry & MOs

Info

ID:	384728
PubChem CID:	134977579
Reduced:	PO2C10H15 (1)
Stoich.:	AB2C10D15 (1)
Weight, g/mol:	411.245292
ΔH_f, kcal/mol:	-126.25
Dipole, Da:	7.58
IP(EA), eV:	-10.06(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(Z)-2-acetyl-3-hydroxy-1-phenylbut-2-enyl]-dibutyl-phenylphosphanium

Drug info:

PubChemData

Smile

CP1(=O)CC(=O)C=C2C1CCCC2

DOS

IR

Vibrations