Geometry & MOs

Info

ID:	267955
PubChem CID:	103590705
Reduced:	FON3C15H22 (1)
Stoich.:	ABC3D15E22 (1)
Weight, g/mol:	281.153955
ΔH_f, kcal/mol:	-94.08
Dipole, Da:	4.2
IP(EA), eV:	-8.1(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-amino-4-fluoro-5-methylanilino)-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)NCCC(=O)N2CCCCC2

DOS

IR

Vibrations