Geometry & MOs

Info

ID:	35931
PubChem CID:	7980514
Reduced:	ClO5H13C23 (1)
Stoich.:	AB5C13D23 (1)
Weight, g/mol:	327.088241
ΔH_f, kcal/mol:	-99.04
Dipole, Da:	2.73
IP(EA), eV:	-10.0(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)COC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)Cl

DOS

IR

Vibrations