Geometry & MOs

Info

ID:	154591
PubChem CID:	56314057
Reduced:	FSN3O4C21H26 (1)
Stoich.:	ABC3D4E21F26 (1)
Weight, g/mol:	486.094697
ΔH_f, kcal/mol:	-185.85
Dipole, Da:	10.13
IP(EA), eV:	-9.58(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dichlorophenyl)sulfonyl-N-[2-(2-fluorophenyl)-2-methylpropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC(C)(C)C2=CC=CC=C2F

DOS

IR

Vibrations