Geometry & MOs

Info

ID:	199541
PubChem CID:	79264844
Reduced:	F3N3O3C12H20 (1)
Stoich.:	A3B3C3D12E20 (1)
Weight, g/mol:	311.072905
ΔH_f, kcal/mol:	-297.66
Dipole, Da:	6.16
IP(EA), eV:	-9.24(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methyl-3,5-dioxopiperazine-1-carbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid

Drug info:

PubChemData

Smile

CN(C)C1CCCN(C1)C(=O)N(CC(=O)O)CC(F)(F)F

DOS

IR

Vibrations