Geometry & MOs

Info

ID:	203961
PubChem CID:	79893731
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	196.14633
ΔH_f, kcal/mol:	-112.6
Dipole, Da:	3.08
IP(EA), eV:	-9.69(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-oxaspiro[3.5]nonan-8-yl)butan-2-one

Drug info:

PubChemData

Smile

CCCC(=O)CC1CCOC2(C1)CCC2

DOS

IR

Vibrations