Geometry & MOs

Info

ID:	337902
PubChem CID:	127258525
Reduced:	O2C13H24 (1)
Stoich.:	A2B13C24 (1)
Weight, g/mol:	198.16198
ΔH_f, kcal/mol:	-139.82
Dipole, Da:	1.97
IP(EA), eV:	-10.5(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethylcyclopentyl)methyl butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC1CCCCC1CC

DOS

IR

Vibrations