Geometry & MOs

Info

ID:	406439
PubChem CID:	135077606
Reduced:	NSO4C13H13 (1)
Stoich.:	ABC4D13E13 (1)
Weight, g/mol:	298.059898
ΔH_f, kcal/mol:	-122.68
Dipole, Da:	7.27
IP(EA), eV:	-8.75(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-[3-methyl-1-oxo-1-(2-sulfanylidene-1,3-oxazolidin-3-yl)butan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)OC(C1=CC=CC=C1)C(=O)N2CCOC2=S

DOS

IR

Vibrations