Geometry & MOs

Info

ID:

219307

PubChem CID:

85098646

Reduced:

N2O11H34C43 (1)

Stoich.:

A2B11C34D43 (1)

Weight, g/mol:

754.486728

ΔHf, kcal/mol:

-256.39

Dipole, Da:

3.79

IP(EA), eV:

 -9.82(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[10-acetyloxy-22-(7-acetyloxy-3-hydroxy-5-methyldec-4-en-2-yl)-4,12,20-trihydroxy-3,5,15-trimethyl-2-oxo-1-oxacyclodocos-15-en-8-yl] acetate

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C(C(C(COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6

DOS

IR

Vibrations