Geometry & MOs

Info

ID:

10492

PubChem CID:

102932

Reduced:

BrO9C14H19 (1)

Stoich.:

AB9C14D19 (1)

Weight, g/mol:

410.02124

ΔHf, kcal/mol:

-406.14

Dipole, Da:

4.31

IP(EA), eV:

-10.47(-0.68)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3,4,5-triacetyloxy-6-bromooxan-2-yl)methyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)Br)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations