Geometry & MOs

Info

ID:	209721
PubChem CID:	80708432
Reduced:	FN2O3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	284.209993
ΔH_f, kcal/mol:	-85.5
Dipole, Da:	6.68
IP(EA), eV:	-8.91(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[cyclopentyl-[2-oxo-2-(pentan-2-ylamino)ethyl]amino]acetate

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C1=C(C(=CC=C1)F)[N+](=O)[O-]

DOS

IR

Vibrations