Geometry & MOs

Info

ID:

219095

PubChem CID:

85090505

Reduced:

ClS2N6O6C21H21 (1)

Stoich.:

AB2C6D6E21F21 (1)

Weight, g/mol:

553.192991

ΔHf, kcal/mol:

-82.72

Dipole, Da:

3.08

IP(EA), eV:

 -8.7(-0.97)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

dimethyl-[1-methyl-1-(3-methyl-4-propan-2-yl-4,5-dihydro-1,3-oxazol-3-ium-2-yl)-2H-naphthalen-2-yl]-phenylsilane;trifluoromethanesulfonate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)C(=NOC)C4=NSC(=N4)N)CCl

DOS

IR

Vibrations