Geometry & MOs

Info

ID:	338013
PubChem CID:	127258636
Reduced:	NO3C13H29 (1)
Stoich.:	AB3C13D29 (1)
Weight, g/mol:	231.183444
ΔH_f, kcal/mol:	-205.71
Dipole, Da:	2.05
IP(EA), eV:	-10.17(1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

morpholin-4-ium;octanoate

Drug info:

PubChemData

Smile

CCCCCCCCCC(=O)[O-].CC(C[NH3+])O

DOS

IR

Vibrations