Geometry & MOs

Info

ID:	8550
PubChem CID:	79029
Reduced:	O5C6H10 (1)
Stoich.:	A5B6C10 (1)
Weight, g/mol:	162.052823
ΔH_f, kcal/mol:	-172.05
Dipole, Da:	3.7
IP(EA), eV:	-8.81(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol

Drug info:

PubChemData

Smile

C1C2C(C(C(C(O1)O2)O)O)O

DOS

IR

Vibrations