Geometry & MOs

Info

ID:

44817

PubChem CID:

10506039

Reduced:

SiN2O6C27H40 (1)

Stoich.:

AB2C6D27E40 (1)

Weight, g/mol:

516.32396

ΔHf, kcal/mol:

-238.26

Dipole, Da:

7.11

IP(EA), eV:

 -8.93(-0.52)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5R,8R,9R,10R,12R,13S,14S,15S,16S,17R,19R,20R,21R,24R)-4,25-dioxaundecacyclo[26.5.1.11,30.128,32.05,9.08,12.010,14.013,16.015,19.017,21.020,24]hexatriacontane-3,26-dione

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)O[C@H](C)[C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)OCC3=CC=C(C=C3)OC)[C@H]4CCN(O4)C

DOS

IR

Vibrations