Geometry & MOs

Info

ID:

220088

PubChem CID:

85165227

Reduced:

NSi2O3C40H49 (1)

Stoich.:

AB2C3D40E49 (1)

Weight, g/mol:

648.327148

ΔHf, kcal/mol:

-139.85

Dipole, Da:

3.53

IP(EA), eV:

 -8.96(-0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[12-cyclopentyl-9-cyclopropyl-6-[(2-methyl-1H-indol-3-yl)methyl]-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-3-yl]acetate

Drug info:

PubChemData

Smile

CCC(=O)C=C1C(C(CN1)O[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C)O[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C

DOS

IR

Vibrations