Geometry & MOs

Info

ID:	52665
PubChem CID:	12015650
Reduced:	NF3O3H10C13 (1)
Stoich.:	AB3C3D10E13 (1)
Weight, g/mol:	438.124943
ΔH_f, kcal/mol:	-246.72
Dipole, Da:	5.09
IP(EA), eV:	-10.19(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(E)-3-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]prop-2-enoyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C1COC(=O)N1C(=O)/C=C/C2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations