Geometry & MOs

Info

ID:	18165
PubChem CID:	538639
Reduced:	O9C13H18 (1)
Stoich.:	A9B13C18 (1)
Weight, g/mol:	318.095082
ΔH_f, kcal/mol:	-402.72
Dipole, Da:	2.41
IP(EA), eV:	-11.09(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5,6-diacetyloxy-7-methyl-2-oxo-1,3-dioxepan-4-yl)methyl acetate

Drug info:

PubChemData

Smile

CC1C(C(C(OC(=O)O1)COC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations