Geometry & MOs

Info

ID:

10774

PubChem CID:

107834

Reduced:

O8C27H32 (1)

Stoich.:

A8B27C32 (1)

Weight, g/mol:

484.209718

ΔHf, kcal/mol:

-238.32

Dipole, Da:

7.73

IP(EA), eV:

 -9.55(-1.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1R,3R,8R,24R,25S,26S)-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,17,22-trione

Drug info:

PubChemData

Smile

CC1=C[C@@H]2[C@@]3(CC1)COC(=O)C=C(CCOC(=O)C=CC=CC(=O)O[C@H]4[C@]3([C@]5(CO5)[C@@H](C4)O2)C)C

DOS

IR

Vibrations