Geometry & MOs

Info

ID:	390346
PubChem CID:	134998610
Reduced:	SN2F3O5H17C22 (1)
Stoich.:	AB2C3D5E17F22 (1)
Weight, g/mol:	414.107185
ΔH_f, kcal/mol:	-175.78
Dipole, Da:	6.07
IP(EA), eV:	-9.78(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,4R,5S)-2-(4-methoxyphenyl)-5-methyl-3-phenyl-1,2-oxazolidin-4-yl]-(2-sulfanylidene-1,3-thiazolidin-3-yl)methanone

Drug info:

PubChemData

Smile

C1C(N(OC1C2=CC=C(C=C2)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

DOS

IR

Vibrations