Geometry & MOs

Info

ID:	211588
PubChem CID:	81044515
Reduced:	OSN2C16H26 (1)
Stoich.:	ABC2D16E26 (1)
Weight, g/mol:	296.171162
ΔH_f, kcal/mol:	-47.72
Dipole, Da:	3.18
IP(EA), eV:	-8.85(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-3-piperidin-3-yl-N-(2,2,2-trifluoroethyl)butanamide

Drug info:

PubChemData

Smile

CC(CC(=O)N(C)C(C)C1=CC=CS1)C2CCCNC2

DOS

IR

Vibrations