Geometry & MOs

Info

ID:	20057
PubChem CID:	577914
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	248.141244
ΔH_f, kcal/mol:	-128.43
Dipole, Da:	3.22
IP(EA), eV:	-8.85(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxyphenyl)methyl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)COC(=O)C2CCCCC2

DOS

IR

Vibrations