Geometry & MOs

Info

ID:	83948
PubChem CID:	49862781
Reduced:	ClON3H22C25 (1)
Stoich.:	ABC3D22E25 (1)
Weight, g/mol:	402.183109
ΔH_f, kcal/mol:	49.09
Dipole, Da:	4.2
IP(EA), eV:	-8.32(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(4-naphthalen-2-yloxyphenyl)ethenyl]-1,2,5-trioxaspiro[5.5]undecane

Drug info:

PubChemData

Smile

C1COCCN1C2=CC=C(C=C2)NC3=C4C=C(C=CC4=NC=C3)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations