Geometry & MOs

Info

ID:	261726
PubChem CID:	103247616
Reduced:	N2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	282.155512
ΔH_f, kcal/mol:	-127.22
Dipole, Da:	2.04
IP(EA), eV:	-9.29(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-[(1-piperidin-1-ylpropan-2-ylamino)methyl]propanoic acid

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C)NCC=C(C)C(=O)OC

DOS

IR

Vibrations