Geometry & MOs

Info

ID:	238083
PubChem CID:	92729667
Reduced:	SN3O5C24H31 (1)
Stoich.:	AB3C5D24E31 (1)
Weight, g/mol:	487.214092
ΔH_f, kcal/mol:	-185.21
Dipole, Da:	10.05
IP(EA), eV:	-9.26(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-[3-[(2,4-dimethylphenyl)sulfonylamino]benzoyl]-N-(3-methoxypropyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC[C@@H](C3)C(=O)NCCCOC

DOS

IR

Vibrations