Geometry & MOs

Info

ID:	199514
PubChem CID:	79258857
Reduced:	OF3N3C13H20 (1)
Stoich.:	AB3C3D13E20 (1)
Weight, g/mol:	294.082741
ΔH_f, kcal/mol:	-173.47
Dipole, Da:	3.57
IP(EA), eV:	-10.3(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(furan-2-ylmethylamino)-2-oxoethyl]-(2,2,2-trifluoroethyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC1(CCC(CC1)C2=NOC(=N2)CNCC(F)(F)F)C

DOS

IR

Vibrations