Geometry & MOs

Info

ID:	282609
PubChem CID:	103932805
Reduced:	N2O4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	257.087492
ΔH_f, kcal/mol:	-177.58
Dipole, Da:	5.48
IP(EA), eV:	-9.33(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(2,2,2-trifluoroethoxy)acetyl]amino]pentanoic acid

Drug info:

PubChemData

Smile

CC(CCC(=O)O)NC(=O)C1=CC2=C(C=C1)NC(=O)CC2

DOS

IR

Vibrations