Geometry & MOs

Info

ID:	240650
PubChem CID:	93616946
Reduced:	SN2O4C16H20 (1)
Stoich.:	AB2C4D16E20 (1)
Weight, g/mol:	325.103811
ΔH_f, kcal/mol:	-136.31
Dipole, Da:	6.78
IP(EA), eV:	-9.68(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-pyridin-3-yl-1,2-oxazol-3-yl)-[(3R)-3-(trifluoromethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C(=C(O1)C)S(=O)(=O)N)C(=O)NC[C@H](C)C2=CC=CC=C2

DOS

IR

Vibrations