Geometry & MOs

Info

ID:	151017
PubChem CID:	53790714
Reduced:	N2C8H19 (2)
Stoich.:	A2B8C19 (2)
Weight, g/mol:	208.07693
ΔH_f, kcal/mol:	-53.08
Dipole, Da:	1.45
IP(EA), eV:	-8.87(3.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dihydroxyhexyl 2-sulfanylacetate

Drug info:

PubChemData

Smile

CNCCCCCCCCCCC(CCCNC)(N)N

DOS

IR

Vibrations