Geometry & MOs

Info

ID:	158813
PubChem CID:	56479349
Reduced:	F2O2S2N5H17C21 (1)
Stoich.:	A2B2C2D5E17F21 (1)
Weight, g/mol:	340.02227
ΔH_f, kcal/mol:	-57.85
Dipole, Da:	3.3
IP(EA), eV:	-9.12(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(5-tert-butyl-1,2-oxazol-3-yl)-5-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NNC(=S)N2CC(=O)NC3=NC(=CS3)C4=CC=CC=C4OC(F)F

DOS

IR

Vibrations