Geometry & MOs

Info

ID:	52271
PubChem CID:	12015083
Reduced:	O2C9H11 (2)
Stoich.:	A2B9C11 (2)
Weight, g/mol:	324.136159
ΔH_f, kcal/mol:	-164.59
Dipole, Da:	3.45
IP(EA), eV:	-9.75(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-benzoyl-5-oxo-5-phenylpentanoate

Drug info:

PubChemData

Smile

CCOC(=O)C1(CCCCC1=O)CCC(=O)C2=CC=CC=C2

DOS

IR

Vibrations