Geometry & MOs

Info

ID:	311987
PubChem CID:	126600416
Reduced:	O2N5F6H11C19 (1)
Stoich.:	A2B5C6D11E19 (1)
Weight, g/mol:	487.13306
ΔH_f, kcal/mol:	-263.64
Dipole, Da:	8.25
IP(EA), eV:	-10.04(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[[(2R,5S)-3-[4-cyano-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

C1C(OC(N1C2=CC(=C(C=C2)C#N)C(F)(F)F)C(F)(F)F)C(=O)NC3=CN=C(C=C3)C#N

DOS

IR

Vibrations