Geometry & MOs

Info

ID:	203197
PubChem CID:	79791965
Reduced:	NO2C13H25 (1)
Stoich.:	AB2C13D25 (1)
Weight, g/mol:	388.96412
ΔH_f, kcal/mol:	-136.75
Dipole, Da:	6.03
IP(EA), eV:	-9.68(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-bromo-4-chlorophenoxy)ethylamino]-3,3,3-trifluoro-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CCC1CCCC(C1)NC(C)(CC)C(=O)O

DOS

IR

Vibrations