Geometry & MOs

Info

ID:	240652
PubChem CID:	93616957
Reduced:	NSO5C14H21 (1)
Stoich.:	ABC5D14E21 (1)
Weight, g/mol:	235.087829
ΔH_f, kcal/mol:	-189.6
Dipole, Da:	3.71
IP(EA), eV:	-8.78(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[(2R)-2-methylmorpholin-4-yl]-2-methylsulfonylpropan-1-one

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N(C)CC1=C(C(=CC=C1)OC)OC)S(=O)(=O)C

DOS

IR

Vibrations