Geometry & MOs

Info

ID:	51320
PubChem CID:	12013967
Reduced:	OSnC16H22 (1)
Stoich.:	ABC16D22 (1)
Weight, g/mol:	596.280395
ΔH_f, kcal/mol:	13.75
Dipole, Da:	2.79
IP(EA), eV:	-7.97(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(2,6-dimethylphenyl) [(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methyl] phosphite

Drug info:

PubChemData

Smile

C1CCCC(CCC1)(/C=C/[Sn]C2=CC=CC=C2)O

DOS

IR

Vibrations