Geometry & MOs

Info

ID:	193804
PubChem CID:	78440469
Reduced:	NO5C13H23 (1)
Stoich.:	AB5C13D23 (1)
Weight, g/mol:	203.118438
ΔH_f, kcal/mol:	-235.41
Dipole, Da:	4.08
IP(EA), eV:	-9.96(0.0)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

dimethyl-(5-oxo-5-pyridin-4-ylpenta-1,3-dienyl)azanium

Drug info:

PubChemData

Smile

CCCCCOC(=O)C(CC(=O)[O-])[NH+]1CCOCC1

DOS

IR

Vibrations