Geometry & MOs

Info

ID:	396057
PubChem CID:	135027322
Reduced:	SN3O4C14H21 (1)
Stoich.:	AB3C4D14E21 (1)
Weight, g/mol:	338.202799
ΔH_f, kcal/mol:	-127.91
Dipole, Da:	4.37
IP(EA), eV:	-8.86(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-3,3-dimethyl-1-piperidin-1-ylbutan-2-yl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CC(C([C@@H](O1)SC2=NC=CC=N2)OC(=O)OC)N(C)C

DOS

IR

Vibrations