Geometry & MOs

Info

ID:	238091
PubChem CID:	92729675
Reduced:	SN3O6C24H31 (1)
Stoich.:	AB3C6D24E31 (1)
Weight, g/mol:	461.117605
ΔH_f, kcal/mol:	-211.7
Dipole, Da:	12.23
IP(EA), eV:	-8.64(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-[3-[(4-chlorophenyl)sulfonylamino]benzoyl]-N-cyclopropylpiperidine-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