Geometry & MOs

Info

ID:	13169
PubChem CID:	222385
Reduced:	ClO2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	238.076057
ΔH_f, kcal/mol:	-92.19
Dipole, Da:	2.33
IP(EA), eV:	-9.92(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl 4-chlorobenzoate

Drug info:

PubChemData

Smile

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations