Geometry & MOs

Info

ID:	22275
PubChem CID:	596505
Reduced:	N2O3C13H18 (1)
Stoich.:	A2B3C13D18 (1)
Weight, g/mol:	250.131742
ΔH_f, kcal/mol:	-117.51
Dipole, Da:	6.18
IP(EA), eV:	-8.84(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-(2,6-dimethylmorpholin-4-yl)benzoic acid

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)C2=C(C=C(C=C2)N)C(=O)O

DOS

IR

Vibrations