Geometry & MOs

Info

ID:	285411
PubChem CID:	104104257
Reduced:	N3O4C12H19 (1)
Stoich.:	A3B4C12D19 (1)
Weight, g/mol:	283.087829
ΔH_f, kcal/mol:	-153.42
Dipole, Da:	1.14
IP(EA), eV:	-9.47(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-5-methylsulfonylphenyl)-(oxazinan-2-yl)methanone

Drug info:

PubChemData

Smile

CCC1(C(=O)N(C(=O)N1)CC(=O)N2CCCCO2)C

DOS

IR

Vibrations