Geometry & MOs

Info

ID:	311111
PubChem CID:	126589443
Reduced:	NO4C21H27 (1)
Stoich.:	AB4C21D27 (1)
Weight, g/mol:	331.158372
ΔH_f, kcal/mol:	-119.85
Dipole, Da:	1.87
IP(EA), eV:	-8.58(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-ethyl-2-methylphenoxy)methyl]-5-fluorophenyl]-N-hydroxypropanamide

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=C(C=C2)OCC)N(C(=O)CC)O)C

DOS

IR

Vibrations