Geometry & MOs

Info

ID:	216478
PubChem CID:	85086294
Reduced:	O5C14H24 (1)
Stoich.:	A5B14C24 (1)
Weight, g/mol:	272.141245
ΔH_f, kcal/mol:	-245.02
Dipole, Da:	2.27
IP(EA), eV:	-9.72(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-3-phenylmethoxy-1-oxaspiro[4.5]dec-6-en-2-one

Drug info:

PubChemData

Smile

CC1(OC(C(O1)CO)CC=CCCCC(=O)OC)C

DOS

IR

Vibrations