Geometry & MOs

Info

ID:	13116
PubChem CID:	221697
Reduced:	OC7H13 (2)
Stoich.:	AB7C13 (2)
Weight, g/mol:	226.19328
ΔH_f, kcal/mol:	-145.48
Dipole, Da:	1.53
IP(EA), eV:	-10.63(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylethyl hexanoate

Drug info:

PubChemData

Smile

CCCCCC(=O)OCCC1CCCCC1

DOS

IR

Vibrations