Geometry & MOs

Info

ID:	23856
PubChem CID:	606836
Reduced:	ClN2F3O3H10C15 (1)
Stoich.:	AB2C3D3E10F15 (1)
Weight, g/mol:	358.033204
ΔH_f, kcal/mol:	-174.13
Dipole, Da:	6.82
IP(EA), eV:	-9.77(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)[N+](=O)[O-]

DOS

IR

Vibrations