Geometry & MOs

Info

ID:	230010
PubChem CID:	87569869
Reduced:	O4C15H28 (1)
Stoich.:	A4B15C28 (1)
Weight, g/mol:	386.122166
ΔH_f, kcal/mol:	-214.25
Dipole, Da:	2.2
IP(EA), eV:	-10.82(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethyl]-1,3-dithian-2-yl]ethyl acetate

Drug info:

PubChemData

Smile

CCCCCCC(CCCC)COC(=O)C(=O)OC

DOS

IR

Vibrations