Geometry & MOs

Info

ID:	195349
PubChem CID:	78676826
Reduced:	FCl2O2N3C18H18 (1)
Stoich.:	AB2C2D3E18F18 (1)
Weight, g/mol:	387.108715
ΔH_f, kcal/mol:	-110.32
Dipole, Da:	5.34
IP(EA), eV:	-9.41(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(4-chlorophenoxy)ethyl-methyl-[1-oxo-1-(2,3,4-trifluoroanilino)propan-2-yl]azanium

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=CC(=C1)Cl)Cl)N(C)CC(=O)NC2=CC(=CC=C2)F

DOS

IR

Vibrations