Geometry & MOs

Info

ID:	416350
PubChem CID:	135089363
Reduced:	Cl2N2O2C17H22 (1)
Stoich.:	A2B2C2D17E22 (1)
Weight, g/mol:	347.060963
ΔH_f, kcal/mol:	-96.94
Dipole, Da:	3.92
IP(EA), eV:	-9.1(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]-2-(thiophen-2-ylsulfonylamino)acetamide

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@@]12CCCN(C2)C(=O)NC3=C(C=CC=C3Cl)Cl

DOS

IR

Vibrations