Geometry & MOs

Info

ID:	145979
PubChem CID:	53620688
Reduced:	ClON5C17H18 (1)
Stoich.:	ABC5D17E18 (1)
Weight, g/mol:	334.114042
ΔH_f, kcal/mol:	53.79
Dipole, Da:	7.27
IP(EA), eV:	-8.87(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-3-[1-oxo-1-(2,2,2-trifluoroethylamino)propan-2-yl]oxybenzamide

Drug info:

PubChemData

Smile

C1COC(CN1CC2=C(C=CC3=C2N=CC=C3)Cl)CN4C=NC=N4

DOS

IR

Vibrations