Geometry & MOs

Info

ID:	13395
PubChem CID:	228722
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	210.16198
ΔH_f, kcal/mol:	-126.19
Dipole, Da:	2.36
IP(EA), eV:	-10.51(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclohexylcyclohexyl) formate

Drug info:

PubChemData

Smile

C1CCC(CC1)C2CCCCC2OC=O

DOS

IR

Vibrations