Geometry & MOs

Info

ID:	220579
PubChem CID:	85197870
Reduced:	OC5H7 (4)
Stoich.:	AB5C7 (4)
Weight, g/mol:	332.198759
ΔH_f, kcal/mol:	-163.07
Dipole, Da:	2.95
IP(EA), eV:	-9.47(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-hydroxy-6,10-dimethyl-8-oxo-2-prop-1-en-2-ylspiro[4.5]dec-9-en-4-yl) 3-methylbut-2-enoate

Drug info:

PubChemData

Smile

CC(=CCO)CCC(C(C)(CCC=C)O)OC(=O)C1=CC=CC=C1

DOS

IR

Vibrations