Geometry & MOs

Info

ID:	352083
PubChem CID:	127283151
Reduced:	SN3O5C13H25 (1)
Stoich.:	AB3C5D13E25 (1)
Weight, g/mol:	258.140199
ΔH_f, kcal/mol:	-243.69
Dipole, Da:	1.72
IP(EA), eV:	-9.51(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(oxan-2-ylmethyl)thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCC(C1)NC(=O)NCC2(CCOCC2)O

DOS

IR

Vibrations