Geometry & MOs

Info

ID:	218219
PubChem CID:	85089041
Reduced:	NO4C27H37 (1)
Stoich.:	AB4C27D37 (1)
Weight, g/mol:	440.00332
ΔH_f, kcal/mol:	-186.65
Dipole, Da:	3.98
IP(EA), eV:	-8.99(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-cyano-3-iodophenyl)-3-(4-fluorophenoxy)-2-hydroxy-2-methylpropanamide

Drug info:

PubChemData

Smile

CC1CCC2(C(C3C(O2)C=C4C3(C(=O)CC5C4CCC6C5(C=C(C(=O)C6)N)C)C)C)OC1

DOS

IR

Vibrations