Geometry & MOs

Info

ID:	306319
PubChem CID:	125003754
Reduced:	SN3O4C18H27 (1)
Stoich.:	AB3C4D18E27 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-164.11
Dipole, Da:	5.83
IP(EA), eV:	-9.2(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-[4-[(1-methylsulfonylpiperidin-4-yl)methyl]pyridin-2-yl]-4-propan-2-yl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CC(C)[C@@H]1COC(=O)N1C2=NC=CC(=C2)CC3CCN(CC3)S(=O)(=O)C

DOS

IR

Vibrations