Geometry & MOs

Info

ID:	145750
PubChem CID:	53587299
Reduced:	ClFN3O3H13C16 (1)
Stoich.:	ABC3D3E13F16 (1)
Weight, g/mol:	340.145678
ΔH_f, kcal/mol:	-91.95
Dipole, Da:	4.3
IP(EA), eV:	-10.0(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-[2-(4-methylphenoxy)ethyl]piperidine-3-sulfonamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)C(C#N)NC(=O)CCNC(=O)C2=CC=CO2)F

DOS

IR

Vibrations