Geometry & MOs

Info

ID:	4655
PubChem CID:	11816
Reduced:	OH4C5 (3)
Stoich.:	AB4C5 (3)
Weight, g/mol:	240.078644
ΔH_f, kcal/mol:	-62.63
Dipole, Da:	4.64
IP(EA), eV:	-9.92(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-benzoylbenzoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2

DOS

IR

Vibrations