Geometry & MOs

Info

ID:

15214

PubChem CID:

433531

Reduced:

O5C14H15 (2)

Stoich.:

A5B14C15 (2)

Weight, g/mol:

526.183897

ΔHf, kcal/mol:

-255.01

Dipole, Da:

6.21

IP(EA), eV:

 -9.52(-0.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

15-hydroxy-11,18,21-trimethyl-5,17,24,28,29-pentaoxanonacyclo[17.9.1.11,20.02,12.04,6.06,11.015,19.018,23.021,26]triacont-8-ene-10,16,25,30-tetrone

Drug info:

PubChemData

Smile

CC12CC3C4(C56C1C(=O)C(O5)(C7CC8C9(O8)CC=CC(=O)C9(C7CCC6(C(=O)O4)O)C)OCC2C(=O)O3)C

DOS

IR

Vibrations