Geometry & MOs

Info

ID:	8752
PubChem CID:	81039
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	-129.08
Dipole, Da:	1.97
IP(EA), eV:	-10.41(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1CCCCC1

DOS

IR

Vibrations