Geometry & MOs

Info

ID:	13173
PubChem CID:	222410
Reduced:	OC8H14 (2)
Stoich.:	AB8C14 (2)
Weight, g/mol:	252.20893
ΔH_f, kcal/mol:	-149.35
Dipole, Da:	2.1
IP(EA), eV:	-10.52(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylcyclohexyl) 3-cyclohexylpropanoate

Drug info:

PubChemData

Smile

CC1CCC(CC1)OC(=O)CCC2CCCCC2

DOS

IR

Vibrations