Geometry & MOs

Info

ID:	411965
PubChem CID:	135084821
Reduced:	PSi2C24H41 (1)
Stoich.:	AB2C24D41 (1)
Weight, g/mol:	428.209993
ΔH_f, kcal/mol:	-64.45
Dipole, Da:	2.69
IP(EA), eV:	-8.09(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(3-methoxyquinolin-5-yl)methyl] benzoate

Drug info:

PubChemData

Smile

C[Si](C)(C)C1C=CC=C1CP(CC2=CC=CC2[Si](C)(C)C)C3CCCCC3

DOS

IR

Vibrations