Geometry & MOs

Info

ID:	405987
PubChem CID:	135076190
Reduced:	BrO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	419.09447
ΔH_f, kcal/mol:	-114.93
Dipole, Da:	3.92
IP(EA), eV:	-9.01(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-benzoylphenyl)-N-(2,3,4,5,6-pentafluorophenyl)propanamide

Drug info:

PubChemData

Smile

CC(C)(C1=C(C=CC(=C1)OC)Br)C(=O)OC

DOS

IR

Vibrations