Geometry & MOs

Info

ID:	211593
PubChem CID:	81044522
Reduced:	OSN3C14H23 (1)
Stoich.:	ABC3D14E23 (1)
Weight, g/mol:	280.176248
ΔH_f, kcal/mol:	-46.77
Dipole, Da:	4.85
IP(EA), eV:	-9.03(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CNC(=O)CC(C)C2CCCNC2

DOS

IR

Vibrations