Geometry & MOs

Info

ID:

26033

PubChem CID:

636618

Reduced:

O2C15H26 (1)

Stoich.:

A2B15C26 (1)

Weight, g/mol:

763.268749

ΔHf, kcal/mol:

-127.13

Dipole, Da:

1.8

IP(EA), eV:

 -10.02(0.96)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(1S,3R,13R,14S,17S,18R,19R,20S,21S,22R,23R,24R,25S)-19,21,22,24-tetraacetyloxy-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(C)[C@@H]1CC[C@]2([C@@H](CCC(=C)[C@@]2(C1)O)O)C

DOS

IR

Vibrations