Geometry & MOs

Info

ID:	243263
PubChem CID:	99217984
Reduced:	SO2F3N3C15H20 (1)
Stoich.:	AB2C3D3E15F20 (1)
Weight, g/mol:	374.07344
ΔH_f, kcal/mol:	-229.29
Dipole, Da:	7.69
IP(EA), eV:	-9.31(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-benzylsulfanyl-N-(4-methyl-1,3-thiazol-2-yl)-N-(2,2,2-trifluoroethyl)propanamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC[C@H](C1)C(=O)N(CC(F)(F)F)C2=NC(=CS2)C

DOS

IR

Vibrations