Geometry & MOs

Info

ID:	238181
PubChem CID:	92729766
Reduced:	SN3O4C23H29 (1)
Stoich.:	AB3C4D23E29 (1)
Weight, g/mol:	443.187878
ΔH_f, kcal/mol:	-147.64
Dipole, Da:	7.89
IP(EA), eV:	-9.43(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-[3-[(2-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=CC=C3C

DOS

IR

Vibrations