Geometry & MOs

Info

ID:	240634
PubChem CID:	93616893
Reduced:	NSO3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	267.092915
ΔH_f, kcal/mol:	-119.15
Dipole, Da:	2.37
IP(EA), eV:	-8.93(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylsulfonylpropan-1-one

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCCC2=CC=CC=C21)S(=O)(=O)C

DOS

IR

Vibrations