Geometry & MOs

Info

ID:	231852
PubChem CID:	87574778
Reduced:	SiCl3O5C20H41 (1)
Stoich.:	AB3C5D20E41 (1)
Weight, g/mol:	455.278407
ΔH_f, kcal/mol:	-377.7
Dipole, Da:	3.09
IP(EA), eV:	-9.86(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(3,3-dimethyl-1,2,5-trioxaspiro[5.5]undecan-9-yl)-4-N-(6-methoxyquinolin-8-yl)cyclohexane-1,4-diamine

Drug info:

PubChemData

Smile

COCCOCCOCCOCCOCCCCCCCCCCC[Si](Cl)(Cl)Cl

DOS

IR

Vibrations