Geometry & MOs

Info

ID:	8266
PubChem CID:	75836
Reduced:	O2C13H26 (1)
Stoich.:	A2B13C26 (1)
Weight, g/mol:	214.19328
ΔH_f, kcal/mol:	-148.58
Dipole, Da:	2.17
IP(EA), eV:	-10.76(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

nonyl butanoate

Drug info:

PubChemData

Smile

CCCCCCCCCOC(=O)CCC

DOS

IR

Vibrations