Geometry & MOs

Info

ID:	238170
PubChem CID:	92729755
Reduced:	FSN3O4C22H26 (1)
Stoich.:	ABC3D4E22F26 (1)
Weight, g/mol:	443.187878
ΔH_f, kcal/mol:	-181.94
Dipole, Da:	6.53
IP(EA), eV:	-8.8(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-[3-[(4-methylphenyl)sulfonylamino]benzoyl]-N-propylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)[C@H]1CCCN(C1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations