Geometry & MOs

Info

ID:

180254

PubChem CID:

76604743

Reduced:

NSiF2O4C15H27 (1)

Stoich.:

ABC2D4E15F27 (1)

Weight, g/mol:

892.415768

ΔHf, kcal/mol:

-343.34

Dipole, Da:

2.71

IP(EA), eV:

 -9.55(-0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[13-acetyloxy-18-(3-benzamido-4-fluoro-2-hydroxy-2-methylpentanoyl)oxy-16-hydroxy-4-[[2-(hydroxymethyl)azetidin-1-yl]methyl]-7,19,20,20-tetramethyl-3,5,11-trioxapentacyclo[14.3.1.02,6.07,14.010,13]icos-1(19)-en-15-yl] benzoate

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)OC1(C(N(C1=O)C(=O)OC(C)C)C(F)F)C

DOS

IR

Vibrations