Geometry & MOs

Info

ID:	337901
PubChem CID:	127258524
Reduced:	O2C11H20 (1)
Stoich.:	A2B11C20 (1)
Weight, g/mol:	212.17763
ΔH_f, kcal/mol:	-119.14
Dipole, Da:	1.88
IP(EA), eV:	-10.62(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethylcyclohexyl)methyl butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC1CCC1CC

DOS

IR

Vibrations