Geometry & MOs

Info

ID:	224674
PubChem CID:	85345856
Reduced:	O2C10H13 (2)
Stoich.:	A2B10C13 (2)
Weight, g/mol:	330.219495
ΔH_f, kcal/mol:	-91.33
Dipole, Da:	4.47
IP(EA), eV:	-8.1(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-2-(2-phenylethyl)-11-propan-2-yl-1,5-dioxaspiro[5.5]undecan-4-one

Drug info:

PubChemData

Smile

CC1=C2C=CC3=C(C=C(C=C3OC)OC)C(C(C2(C)C)(CC1)O)O

DOS

IR

Vibrations