Geometry & MOs

Info

ID:	430021
PubChem CID:	135170078
Reduced:	N2O3C17H20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	298.131742
ΔH_f, kcal/mol:	-60.62
Dipole, Da:	6.41
IP(EA), eV:	-8.78(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2R)-2-methyl-5-phenylmorpholin-4-yl]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C=C/C(=C\C=C(/N)\N1CCOC[C@@H]1C2=CC=CC=C2)/C(=O)O

DOS

IR

Vibrations