Geometry & MOs

Info

ID:	70005
PubChem CID:	47206625
Reduced:	ClFNSO3C13H15 (1)
Stoich.:	ABCDE3F13G15 (1)
Weight, g/mol:	288.114378
ΔH_f, kcal/mol:	-151.16
Dipole, Da:	5.4
IP(EA), eV:	-9.63(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfonyl]acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CC1)S(=O)(=O)CC2=C(C=C(C=C2)F)Cl

DOS

IR

Vibrations