Geometry & MOs

Info

ID:	238090
PubChem CID:	92729674
Reduced:	SN3O6C24H31 (1)
Stoich.:	AB3C6D24E31 (1)
Weight, g/mol:	489.193357
ΔH_f, kcal/mol:	-215.4
Dipole, Da:	3.71
IP(EA), eV:	-9.49(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-[3-[(3-methoxyphenyl)sulfonylamino]benzoyl]-N-(3-methoxypropyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations