Geometry & MOs

Info

ID:	61900
PubChem CID:	26715526
Reduced:	Cl2N2S2O3H14C15 (1)
Stoich.:	A2B2C2D3E14F15 (1)
Weight, g/mol:	404.156992
ΔH_f, kcal/mol:	-85.16
Dipole, Da:	7.16
IP(EA), eV:	-9.56(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(4-fluorophenyl)sulfonyl-N-methyl-N-[(1S)-1-phenylethyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations