Geometry & MOs

Info

ID:	261471
PubChem CID:	103235287
Reduced:	N2O3C12H20 (1)
Stoich.:	A2B3C12D20 (1)
Weight, g/mol:	201.061278
ΔH_f, kcal/mol:	-94.98
Dipole, Da:	3.34
IP(EA), eV:	-8.89(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-4-(2,2,2-trifluoroethylamino)butanoic acid

Drug info:

PubChemData

Smile

CC(C1=CC=C(O1)C(=O)OC)NCCN(C)C

DOS

IR

Vibrations