Geometry & MOs

Info

ID:	9337
PubChem CID:	88078
Reduced:	O2C13H24 (1)
Stoich.:	A2B13C24 (1)
Weight, g/mol:	212.17763
ΔH_f, kcal/mol:	-140.45
Dipole, Da:	2.06
IP(EA), eV:	-10.33(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-tert-butylcyclohexyl)methyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCC1CCC(CC1)C(C)(C)C

DOS

IR

Vibrations