Geometry & MOs

Info

ID:	269573
PubChem CID:	103618000
Reduced:	NF3O3C12H14 (1)
Stoich.:	AB3C3D12E14 (1)
Weight, g/mol:	301.108086
ΔH_f, kcal/mol:	-286.22
Dipole, Da:	3.2
IP(EA), eV:	-9.42(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5-chlorofuran-2-carbonyl)-(2-ethylbutyl)amino]acetate

Drug info:

PubChemData

Smile

CCCN(CC(F)(F)F)C(=O)C1=C(C=C(C=C1)O)O

DOS

IR

Vibrations