Geometry & MOs

Info

ID:	243262
PubChem CID:	99217980
Reduced:	SO2F3N4C19H19 (1)
Stoich.:	AB2C3D4E19F19 (1)
Weight, g/mol:	363.122833
ΔH_f, kcal/mol:	-116.46
Dipole, Da:	6.08
IP(EA), eV:	-9.48(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(4-methyl-1,3-thiazol-2-yl)-1-propanoyl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NOC2=C1C(=CC(=N2)C3CC3)C(=O)N(CC(F)(F)F)C4=NC(=CS4)C

DOS

IR

Vibrations