Geometry & MOs

Info

ID:	139060
PubChem CID:	52467279
Reduced:	SF2N3O3C15H15 (1)
Stoich.:	AB2C3D3E15F15 (1)
Weight, g/mol:	294.99564
ΔH_f, kcal/mol:	-160.17
Dipole, Da:	7.91
IP(EA), eV:	-9.64(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-N-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)C2=C(C=C(C=C2)F)F)[C@H]3CCS(=O)(=O)C3

DOS

IR

Vibrations