Geometry & MOs

Info

ID:	131471
PubChem CID:	51210235
Reduced:	NSF2O3H13C17 (1)
Stoich.:	ABC2D3E13F17 (1)
Weight, g/mol:	338.166414
ΔH_f, kcal/mol:	-155.99
Dipole, Da:	3.14
IP(EA), eV:	-9.15(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethylsulfonyl-N-(2-propan-2-ylphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=CC(=C(C=C3)F)F

DOS

IR

Vibrations