Geometry & MOs

Info

ID:	251754
PubChem CID:	103106648
Reduced:	ClON3C13H20 (1)
Stoich.:	ABC3D13E20 (1)
Weight, g/mol:	269.153955
ΔH_f, kcal/mol:	-51.47
Dipole, Da:	2.77
IP(EA), eV:	-8.06(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-4-fluoro-5-methoxyanilino)-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC1=CC(=C(C=C1C)N)Cl

DOS

IR

Vibrations