Geometry & MOs

Info

ID:	369316
PubChem CID:	127332317
Reduced:	OSN3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	271.081305
ΔH_f, kcal/mol:	-25.26
Dipole, Da:	1.76
IP(EA), eV:	-8.85(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)NC2=CC=CC=N2)C

DOS

IR

Vibrations