Geometry & MOs

Info

ID:	342191
PubChem CID:	127264904
Reduced:	ClNO2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	304.098998
ΔH_f, kcal/mol:	-109.3
Dipole, Da:	5.3
IP(EA), eV:	-9.22(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-(2-morpholin-4-ylethylamino)benzoic acid;hydrochloride

Drug info:

PubChemData

Smile

CC1=C2CC(NC2=CC=C1)C(=O)O.Cl

DOS

IR

Vibrations