Geometry & MOs

Info

ID:	175780
PubChem CID:	75946323
Reduced:	SN2O3C13H24 (1)
Stoich.:	AB2C3D13E24 (1)
Weight, g/mol:	448.129063
ΔH_f, kcal/mol:	-155.45
Dipole, Da:	7.57
IP(EA), eV:	-8.99(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxo-4-piperidin-1-ylthiolan-3-yl)-3-[5-(2-fluorophenyl)thiophen-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1CS(=O)(=O)CC1N2CCCCC2

DOS

IR

Vibrations