Geometry & MOs

Info

ID:	349046
PubChem CID:	127274772
Reduced:	SN2O4C13H22 (1)
Stoich.:	AB2C4D13E22 (1)
Weight, g/mol:	289.134779
ΔH_f, kcal/mol:	-177.05
Dipole, Da:	6.91
IP(EA), eV:	-9.03(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxan-2-ylmethyl)-2-(oxan-2-ylmethylsulfanyl)acetamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CSCC1C(=O)NCC2COCCO2

DOS

IR

Vibrations