Geometry & MOs

Info

ID:	238131
PubChem CID:	92729715
Reduced:	SN3O4C26H35 (1)
Stoich.:	AB3C4D26E35 (1)
Weight, g/mol:	485.234828
ΔH_f, kcal/mol:	-160.82
Dipole, Da:	4.86
IP(EA), eV:	-8.92(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(2-methylpropyl)-1-[3-[(2,4,6-trimethylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC[C@@H](C3)C(=O)NCC(C)C

DOS

IR

Vibrations