Geometry & MOs

Info

ID:	203189
PubChem CID:	79791696
Reduced:	N2F3O4H11C12 (1)
Stoich.:	A2B3C4D11E12 (1)
Weight, g/mol:	310.077656
ΔH_f, kcal/mol:	-305.53
Dipole, Da:	4.79
IP(EA), eV:	-10.78(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(2,5-dioxopyrrolidin-1-yl)propanoylamino]-3,3,3-trifluoro-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC(C(=O)O)(C(F)(F)F)NC(=O)C1=CC=C(C=C1)C(=O)N

DOS

IR

Vibrations