Geometry & MOs

Info

ID:	238167
PubChem CID:	92729752
Reduced:	ClSN3O4C22H26 (1)
Stoich.:	ABC3D4E22F26 (1)
Weight, g/mol:	463.133255
ΔH_f, kcal/mol:	-142.94
Dipole, Da:	3.68
IP(EA), eV:	-9.5(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-[3-[(4-chlorophenyl)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)Cl

DOS

IR

Vibrations