Geometry & MOs

Info

ID:	48049
PubChem CID:	10536781
Reduced:	FO4C10H15 (1)
Stoich.:	AB4C10D15 (1)
Weight, g/mol:	218.105528
ΔH_f, kcal/mol:	-229.2
Dipole, Da:	1.64
IP(EA), eV:	-10.97(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-5-phenyl-1,3,4-oxadiazol-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C(=CC(C)F)C(=O)OCC

DOS

IR

Vibrations