Geometry & MOs

Info

ID:	25744
PubChem CID:	630074
Reduced:	ON2H20C22 (1)
Stoich.:	AB2C20D22 (1)
Weight, g/mol:	472.318875
ΔH_f, kcal/mol:	37.08
Dipole, Da:	2.01
IP(EA), eV:	-8.15(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5',7,9,13-tetramethyl-3'-oxospiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl) acetate

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C=NC3=C(C=C(C=C3)C)O)C4=CC=CC=C41

DOS

IR

Vibrations