Geometry & MOs

Info

ID:	148330
PubChem CID:	53787992
Reduced:	OC27H44 (1)
Stoich.:	AB27C44 (1)
Weight, g/mol:	280.118498
ΔH_f, kcal/mol:	-103.25
Dipole, Da:	1.71
IP(EA), eV:	-8.51(0.38)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(4-formyloxymorpholin-4-ium-4-yl)-3-phenylpropanoic acid

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)C2CCC(CC2)CCC3=CC=C(C=C3)OCCC

DOS

IR

Vibrations