Geometry & MOs

Info

ID:	60348
PubChem CID:	26683861
Reduced:	SN2O5C27H34 (1)
Stoich.:	AB2C5D27E34 (1)
Weight, g/mol:	428.213364
ΔH_f, kcal/mol:	-174.46
Dipole, Da:	8.04
IP(EA), eV:	-8.48(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(1R)-1-phenylethyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC[C@@H]3C4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations