Geometry & MOs

Info

ID:	47752
PubChem CID:	10535101
Reduced:	OC3H4 (3)
Stoich.:	AB3C4 (3)
Weight, g/mol:	168.11503
ΔH_f, kcal/mol:	-110.36
Dipole, Da:	2.04
IP(EA), eV:	-9.62(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butyl-5,5-dimethylfuran-2-one

Drug info:

PubChemData

Smile

CCC1=C(OC=C1C)C(=O)OC

DOS

IR

Vibrations