Geometry & MOs

Info

ID:

221749

PubChem CID:

85286104

Reduced:

SO7C35H52 (1)

Stoich.:

AB7C35D52 (1)

Weight, g/mol:

616.375917

ΔHf, kcal/mol:

-294.68

Dipole, Da:

7.18

IP(EA), eV:

 -9.28(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[3,4-bis(trimethylsilyloxy)-5-[[3-(3-trimethylsilyloxybutan-2-yl)oxiran-2-yl]methyl]oxan-2-yl]-N-[(dimethylamino)methyl]-3-methylbut-2-enamide

Drug info:

PubChemData

Smile

CCCCCCCCC=CC(C1CCC(O1)C(CCCOCC2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C)OCOC

DOS

IR

Vibrations