Geometry & MOs

Info

ID:	438474
PubChem CID:	135228216
Reduced:	ClSO2N3C16H28 (1)
Stoich.:	ABC2D3E16F28 (1)
Weight, g/mol:	247.02787
ΔH_f, kcal/mol:	-92.68
Dipole, Da:	2.82
IP(EA), eV:	-8.7(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2-thione

Drug info:

PubChemData

Smile

CCCCC(CC)COC(=O)CCS/C(=C(\N)/N=C(\C)/Cl)/N=C

DOS

IR

Vibrations