Geometry & MOs

Info

ID:	442626
PubChem CID:	135253415
Reduced:	O4C13H24 (1)
Stoich.:	A4B13C24 (1)
Weight, g/mol:	272.198759
ΔH_f, kcal/mol:	-226.38
Dipole, Da:	0.45
IP(EA), eV:	-10.79(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-oxoheptoxy)ethyl hexanoate

Drug info:

PubChemData

Smile

CCCCCC(=O)OCCCCOC(=O)CC

DOS

IR

Vibrations