Geometry & MOs

Info

ID:	154262
PubChem CID:	56313670
Reduced:	FN2O2C21H21 (1)
Stoich.:	AB2C2D21E21 (1)
Weight, g/mol:	460.183207
ΔH_f, kcal/mol:	-68.83
Dipole, Da:	3.85
IP(EA), eV:	-9.25(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-acetylphenyl)sulfonyl-N-[2-(2-fluorophenyl)-2-methylpropyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=CC=CC=C2)C(=O)NCC(C)(C)C3=CC=CC=C3F

DOS

IR

Vibrations