Geometry & MOs

Info

ID:

224779

PubChem CID:

85352080

Reduced:

O3Si4C34H64 (1)

Stoich.:

A3B4C34D64 (1)

Weight, g/mol:

802.440446

ΔHf, kcal/mol:

-280.19

Dipole, Da:

3.15

IP(EA), eV:

-8.97(-0.32)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

8-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[4-(4-phenylphenyl)but-2-ynoxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)OC=C1CCCC(C1O[Si](CC)(CC)CC)(C#CC=CC#C[Si](C)(C)C)O[Si](CC)(CC)CC

DOS

IR

Vibrations