Geometry & MOs

Info

ID:	357355
PubChem CID:	127293988
Reduced:	SN2O2C8H11 (2)
Stoich.:	AB2C2D8E11 (2)
Weight, g/mol:	393.118084
ΔH_f, kcal/mol:	-136.71
Dipole, Da:	12.82
IP(EA), eV:	-8.68(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-N-(2-thiomorpholin-4-ylsulfonylethyl)quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(C(=O)N1)C2=CC=C(C=C2)C(=O)NCCS(=O)(=O)N3CCSCC3

DOS

IR

Vibrations