Geometry & MOs

Info

ID:	340431
PubChem CID:	127262442
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	278.188195
ΔH_f, kcal/mol:	-139.72
Dipole, Da:	2.63
IP(EA), eV:	-8.84(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-octoxyphenyl)methyl acetate

Drug info:

PubChemData

Smile

CCCCCCOC1=CC=CC(=C1)COC(=O)C

DOS

IR

Vibrations