Geometry & MOs

Info

ID:	306318
PubChem CID:	125003737
Reduced:	N5O5C20H27 (1)
Stoich.:	A5B5C20D27 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-154.64
Dipole, Da:	3.75
IP(EA), eV:	-8.09(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-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)OC(=O)N1CCO[C@H](C1)C2=NC(=CC=C2)NC3=CN(N=C3)CC(=O)OC

DOS

IR

Vibrations