Geometry & MOs

Info

ID:	176920
PubChem CID:	76114129
Reduced:	O3C15H28 (1)
Stoich.:	A3B15C28 (1)
Weight, g/mol:	293.98652
ΔH_f, kcal/mol:	-176.36
Dipole, Da:	1.21
IP(EA), eV:	-9.71(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(methoxyamino)ethylidene]pyridin-1-ium-3-one;iodide

Drug info:

PubChemData

Smile

CCCCCCOC(C)OC(=O)CCCC=CC

DOS

IR

Vibrations