Geometry & MOs

Info

ID:	240964
PubChem CID:	93618452
Reduced:	SN2O4C15H16 (1)
Stoich.:	AB2C4D15E16 (1)
Weight, g/mol:	339.030762
ΔH_f, kcal/mol:	-151.19
Dipole, Da:	8.38
IP(EA), eV:	-9.45(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4R)-6-chloro-3,4-dihydro-2H-thiochromen-4-yl]-2-(2,2,2-trifluoroethoxy)acetamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C[C@@H]1NC(=O)CC2=CC3=CC=CC=C3NC2=O

DOS

IR

Vibrations