Geometry & MOs

Info

ID:	243083
PubChem CID:	99215428
Reduced:	FSN3O3C19H26 (1)
Stoich.:	ABC3D3E19F26 (1)
Weight, g/mol:	409.236542
ΔH_f, kcal/mol:	-132.22
Dipole, Da:	9.46
IP(EA), eV:	-9.0(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-benzyl-N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC[C@H](C)NS(=O)(=O)C1=CN=C(C=C1)N(C)CC2=CC(=C(C=C2)OC)F

DOS

IR

Vibrations