Geometry & MOs

Info

ID:	143106
PubChem CID:	53146684
Reduced:	SN3O3C16H21 (1)
Stoich.:	AB3C3D16E21 (1)
Weight, g/mol:	359.050668
ΔH_f, kcal/mol:	-53.08
Dipole, Da:	4.14
IP(EA), eV:	-9.23(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-4-yl]-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C3=NOC(=C3)N

DOS

IR

Vibrations