Geometry & MOs

Info

ID:	260840
PubChem CID:	103206657
Reduced:	F2N2O3C14H16 (1)
Stoich.:	A2B2C3D14E16 (1)
Weight, g/mol:	323.99728
ΔH_f, kcal/mol:	-194.0
Dipole, Da:	5.17
IP(EA), eV:	-8.86(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-2,5-dimethylphenyl)-2-(2,2,2-trifluoroethoxy)ethanone

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)C(=O)CCOCC(F)F)N(C1=O)C

DOS

IR

Vibrations