Geometry & MOs

Info

ID:	144757
PubChem CID:	53408502
Reduced:	ClNO2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	212.132491
ΔH_f, kcal/mol:	-104.48
Dipole, Da:	5.06
IP(EA), eV:	-9.33(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-5-fluorophenyl)methyl-ethylamino]ethanol

Drug info:

PubChemData

Smile

CC1=CC2=C(CCNC2C(=O)O)C=C1.Cl

DOS

IR

Vibrations