Geometry & MOs

Info

ID:	271504
PubChem CID:	103681364
Reduced:	NO3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	247.124215
ΔH_f, kcal/mol:	-159.41
Dipole, Da:	3.74
IP(EA), eV:	-9.5(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-2-(oxolan-2-yl)acetamide

Drug info:

PubChemData

Smile

CCOC1CC(C1(C)C)NC(=O)C(C)(C)OC

DOS

IR

Vibrations