Geometry & MOs

Info

ID:	153758
PubChem CID:	56313069
Reduced:	FN3O5H24C26 (1)
Stoich.:	AB3C5D24E26 (1)
Weight, g/mol:	466.207942
ΔH_f, kcal/mol:	-142.44
Dipole, Da:	2.69
IP(EA), eV:	-8.25(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylpropanamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations