Geometry & MOs

Info

ID:	261948
PubChem CID:	103261008
Reduced:	N2O2F3C6H11 (1)
Stoich.:	A2B2C3D6E11 (1)
Weight, g/mol:	226.168128
ΔH_f, kcal/mol:	-233.63
Dipole, Da:	4.4
IP(EA), eV:	-8.92(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-[(2,6-dimethylpiperidin-1-yl)amino]-2-methylbut-2-enoic acid

Drug info:

PubChemData

Smile

CN(C)NCC(C(=O)O)C(F)(F)F

DOS

IR

Vibrations