Geometry & MOs

Info

ID:

391552

PubChem CID:

135006455

Reduced:

O3C14H24 (1)

Stoich.:

A3B14C24 (1)

Weight, g/mol:

351.061155

ΔHf, kcal/mol:

-146.98

Dipole, Da:

1.44

IP(EA), eV:

-10.03(-0.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-phenylquinolizin-5-ium;hexafluorophosphate

Drug info:

PubChemData

Smile

CCCCCC[C@H](CC(=C)C(=O)OCC)C=O

DOS

IR

Vibrations