Geometry & MOs

Info

ID:	408241
PubChem CID:	135081003
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	174.089209
ΔH_f, kcal/mol:	-105.75
Dipole, Da:	5.17
IP(EA), eV:	-9.9(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-5-methoxy-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CCCCC/C=C/C1CCCOC1=O

DOS

IR

Vibrations