Geometry & MOs

Info

ID:	162798
PubChem CID:	57570894
Reduced:	NO8C20H35 (1)
Stoich.:	AB8C20D35 (1)
Weight, g/mol:	206.097666
ΔH_f, kcal/mol:	-329.18
Dipole, Da:	6.06
IP(EA), eV:	-9.16(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[5-hydroxy-3-(2-hydroxyethyl)pentyl] ethanethioate

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1CO)OCCOCCOCCOCCOCCOCCN)CO

DOS

IR

Vibrations