Geometry & MOs

Info

ID:	275660
PubChem CID:	103816931
Reduced:	NO3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	283.087829
ΔH_f, kcal/mol:	-123.76
Dipole, Da:	0.82
IP(EA), eV:	-9.44(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methylsulfonylpropanamide

Drug info:

PubChemData

Smile

CCOCCC(=O)N[C@H]1[C@H](CC2=CC=CC=C12)O

DOS

IR

Vibrations